SCHEMBL940018

SCHEMBL940018

CCNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Br)c(C(F)(F)F)c3)cc2)ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 13/20 1.00
KDR P35968 3/20 0.66
PDGFRB P09619 3/20 0.65
GSK3B P49841 2/20 0.65
ARAF P10398 2/20 0.65
BRAF P15056 2/20 0.65
MEN1 O00255 1/20 0.65
PLK4 O00444 1/20 0.65
CIT O14578 1/20 0.65
AURKA O14965 1/20 0.65
MUSK O15146 1/20 0.65
EPHB6 O15197 1/20 0.65
MAPK13 O15264 1/20 0.65
MLNR O43193 1/20 0.65
MAP3K7 O43318 1/20 0.65
RIPK2 O43353 1/20 0.65
DYRK3 O43781 1/20 0.65
PDE6D O43924 1/20 0.65
NR1I2 O75469 1/20 0.65
STK10 O94804 1/20 0.65

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
SCHEMBL2478377 0.93 RAF1 (0.86) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL549001 0.90 RAF1 (1.00) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL937568 0.90 RAF1 (1.00) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL548328 0.86 RAF1 (0.79) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL2507080 0.84 RAF1 (0.75) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL13471762 0.83 RAF1 (0.84) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL1506420 0.83 RAF1 (0.86) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL14481765 0.83 RAF1 (0.86) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL5082237 0.82 RAF1 (0.83) RAF1KDRPDGFRBGSK3BARAF
SCHEMBL20909069 0.82 RAF1 (0.82) RAF1KDRPDGFRBGSK3BARAF

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10653684-B2 Aryl ureas with angiogenisis inhibiting activity BAYER HEALTHCARE LLC (US) 2020-05-19 US disclosed
US-20180296541-A9 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2018-10-18 US disclosed
US-20160015697-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2016-01-21 US disclosed
US-8618141-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE LLC (US) 2013-12-31 US disclosed
US-20120289552-A1 ARYL UREAS WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2012-11-15 US disclosed
US-8242147-B2 Aryl ureas with angiogenisis inhibiting activity BAYER HEALTHCARE LLC (US) 2012-08-14 US disclosed
EP-1636585-B2 DIARYL UREAS WITH KINASE INHIBITING ACTIVITY BAYER HEALTHCARE LLC (US) 2012-06-13 EP disclosed
EP-2324825-A1 Aryl ureas with angiogenesis inhibiting activity Bayer Healthcare LLC (US) 2011-05-25 EP disclosed
EP-2289515-A2 Combinations comprising a diaryl urea and an interferon Bayer HealthCare LLC (US) 2011-03-02 EP disclosed
US-20110015195-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY DUMAS JACQUES 2011-01-20 US disclosed
US-7838541-B2 Aryl ureas with angiogenesis inhibiting activity BAYER HEALTHCARE, LLC (US) 2010-11-23 US disclosed
US-20090068146-A1 DIARYL UREAS AND COMBINATIONS BAYER PHARMACEUTICALS CORPORATION 2009-03-12 US disclosed
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity BAYER HEALTHCARE LLC 2008-09-18 US disclosed
EP-1636585-B1 DIARYL UREAS WITH KINASE INHIBITING ACTIVITY BAYER PHARMACEUTICALS CORP (US) 2008-01-16 EP disclosed
US-20070020704-A1 Diaryl ureas with kinase inhibiting activity BAYER HEALTHCARE LLC 2007-01-25 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 (8 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-20180296541-A9 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR RAF1 867/4885KDR 3/4885PDGFRB 117/4885
US-20070020704-A1 Diaryl ureas with kinase inhibiting activity FLT4, FLT1, FLT3 RAF1 51/4885KDR 44/4885PDGFRB 25/4885
US-10653684-B2 Aryl ureas with angiogenisis inhibiting activity FLT1, FLT4, KDR RAF1 867/4885KDR 3/4885PDGFRB 117/4885
US-20110015195-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR RAF1 867/4885KDR 3/4885PDGFRB 117/4885
US-20080227828-A1 Aryl Ureas With Angiogenisis Inhibiting Activity FLT1, FLT4, KDR RAF1 867/4885KDR 3/4885PDGFRB 117/4885
US-20090068146-A1 DIARYL UREAS AND COMBINATIONS NR4A1, NAP1L4, NR4A3 RAF1 4118/4885KDR 2385/4885PDGFRB 3206/4885
US-20120289552-A1 ARYL UREAS WITH ANGIOGENESIS INHIBITING ACTIVITY FLT4, FLT1, KDR RAF1 817/4885KDR 3/4885PDGFRB 137/4885
US-20160015697-A1 ARYL UREAS WITH ANGIOGENISIS INHIBITING ACTIVITY FLT1, FLT4, KDR RAF1 867/4885KDR 3/4885PDGFRB 117/4885

“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.