SCHEMBL620234

SCHEMBL620234

CN1CCCC1CNC(=O)c1cccc(Oc2ccc(N)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.53
CHRNB2 P17787 1/20 0.52
CHRNA4 P43681 1/20 0.52
MCHR1 Q99705 2/20 0.51
MCHR2 Q969V1 1/20 0.51
RAF1 P04049 1/20 0.48
HTR1A P08908 2/20 0.47
LMNA P02545 1/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
CTSK P43235 1/20 0.47
PKM P14618 1/20 0.46
PREP P48147 1/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 1/20 0.46
CCR3 P51677 1/20 0.45
BTK Q06187 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL620731 0.86 CHRNB2 (0.55) RAB9ACHRNB2CHRNA4MCHR1MCHR2
SCHEMBL13746889 0.83 HSD17B10 (0.52) CHRNB2CHRNA4MCHR1MCHR2HTR1A
SCHEMBL5073227 0.81 RAF1 (0.51) RAB9ACHRNB2CHRNA4MCHR1MCHR2
SCHEMBL6014110 0.81 MCHR1 (0.66) MCHR1MCHR2
SCHEMBL17918744 0.79 HPGD (0.59) RAB9AHTR1ACTSLCTSBCTSK
SCHEMBL619962 0.79 RAB9A (0.84) RAB9ALMNAHPGD
SCHEMBL618488 0.78 RAF1 (0.61) MCHR1RAF1LMNAHPGDCCR3
SCHEMBL8049469 0.78 CTSL (0.67) RAB9ACHRNB2CHRNA4MCHR1MCHR2
SCHEMBL17916110 0.77 RAB9A (0.53) RAB9ACHRNB2CHRNA4HTR1ACTSL
SCHEMBL617886 0.74 CYP2C19 (0.71) RAF1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140329866-A1 OMEGA-CARBOXYARL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BAYER HEALTHCARE LLC (US) 2014-11-06 US disclosed
US-8841330-B2 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC (US) 2014-09-23 US disclosed
US-20120142742-A1 OMEGA-CARBOXYARYL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BAYER HEALTHERCARE LLC (US) 2012-06-07 US disclosed
EP-2298311-B1 w-Carboxy aryl substituted diphenyl ureas as p38 kinase inhibitors BAYER HEALTHCARE LLC (US) 2012-05-09 EP disclosed
US-8124630-B2 ω-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC (US) 2012-02-28 US disclosed
US-20120040986-A1 OMEGA CARBOXYARYL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS RIEDL BERND (DE) 2012-02-16 US disclosed
EP-1158985-B1 OMEGA-CARBOXY ARYL SUBSTITUTED DIPHENYL UREAS AS p38 KINASE INHIBITORS BAYER HEALTHCARE LLC (US) 2011-12-28 EP disclosed
US-7928239-B2 Anticarcinogenic agents BAYER HEALTHCARE LLC (US) 2011-04-19 US disclosed
EP-2298311-A1 w-Carboxy aryl substituted diphenyl ureas as p38 kinase inhibitors Bayer Healthcare Llc (US) 2011-03-23 EP disclosed
US-7897623-B2 FDA Orange book listed patent for sorafenib tosylate; tablets BAYER HEALTHCARE LLC (US) 2011-03-01 US disclosed
US-20030139605-A1 Method and/or process for preparing omega-carboxyaryl substituted diphenyl ureas as raf kinas inhibitors BAYER HEALTHCARE LLC 2003-07-24 US disclosed
US-20030105091-A1 Omega-carboxy aryl substituted diphenyl ureas as p38 kinase inhibitors BAYER HEALTHCARE LLC 2003-06-05 US disclosed
US-20020165394-A1 Inhibition of RAF kinase using quinolyl, isoquinolyl or pyridyl ureas BAYER CORPORATION 2002-11-07 US disclosed
US-20020137774-A1 Carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER CORPORATION 2002-09-26 US disclosed
US-20020042517-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER CORPORATION 2002-04-11 US disclosed
US-20010034447-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-10-25 US disclosed
US-20010027202-A1 Omega-carboxyaryl substituted disphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-10-04 US disclosed
US-20010016659-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-08-23 US disclosed
US-20010011135-A1 Omega-carboxyaryl subsituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-08-02 US disclosed
US-20010011136-A1 omega-carboxyyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-08-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010011135-A1 Omega-carboxyaryl subsituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, ARAF RAB9A 1936/4885CHRNB2 4704/4885CHRNA4 4818/4885
US-20020165394-A1 Inhibition of RAF kinase using quinolyl, isoquinolyl or pyridyl ureas BRAF, RAF1, ARAF RAB9A 663/4885CHRNB2 4618/4885CHRNA4 4591/4885
US-20010011136-A1 omega-carboxyyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, ARAF, RAF1 RAB9A 1400/4885CHRNB2 4683/4885CHRNA4 4772/4885
US-20020137774-A1 Carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, NRAS RAB9A 1722/4885CHRNB2 4826/4885CHRNA4 4871/4885
US-20010034447-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, ARAF RAB9A 2093/4885CHRNB2 4710/4885CHRNA4 4810/4885
US-20010016659-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, ARAF RAB9A 2093/4885CHRNB2 4710/4885CHRNA4 4810/4885
US-20030139605-A1 Method and/or process for preparing omega-carboxyaryl substituted diphenyl ureas as raf kinas inhibitors RAF1, BRAF, ARAF RAB9A 2487/4885CHRNB2 4337/4885CHRNA4 4762/4885
US-20030105091-A1 Omega-carboxy aryl substituted diphenyl ureas as p38 kinase inhibitors MAPK1, MAPK8, MAPK3 RAB9A 3451/4885CHRNB2 4264/4885CHRNA4 4649/4885
US-20140329866-A1 OMEGA-CARBOXYARL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF RAB9A 2639/4885CHRNB2 4618/4885CHRNA4 4754/4885
US-20010027202-A1 Omega-carboxyaryl substituted disphenyl ureas as raf kinase inhibitors BRAF, NRAS, ARAF RAB9A 1099/4885CHRNB2 4662/4885CHRNA4 4797/4885
US-20020042517-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, ARAF RAB9A 2093/4885CHRNB2 4710/4885CHRNA4 4810/4885
US-20120040986-A1 OMEGA CARBOXYARYL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BRAF, NRAS, RAF1 RAB9A 2215/4885CHRNB2 4729/4885CHRNA4 4828/4885
US-20120142742-A1 OMEGA-CARBOXYARYL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF RAB9A 2093/4885CHRNB2 4710/4885CHRNA4 4810/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.