SCHEMBL6841257

SCHEMBL6841257

Cc1cc(NC(=O)c2cccc(CCc3cccnc3)c2)ccc1C(C)C

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.55
BRAF P15056 7/20 0.53
NAMPT P43490 1/20 0.52
NPC1 O15118 4/20 0.52
ADRB2 P07550 1/20 0.51
ADRB1 P08588 1/20 0.51
ADRB3 P13945 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
HTT P42858 1/20 0.49
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.47
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46
DDR1 Q08345 1/20 0.46
DDR2 Q16832 1/20 0.46
CSF1R P07333 1/20 0.46

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
SCHEMBL6846851 0.82 MMP9 (0.43) RAB9ABRAFNAMPTNPC1ADRB2
SCHEMBL6844680 0.81 CXCR2 (0.46) RAB9ABRAFNAMPTNPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL6841465 0.78 RAB9A (0.61) RAB9ABRAFNPC1ADRB2ADRB1
SCHEMBL17409720 0.77 KCNK3 (0.70) RAB9ANPC1TP53POLBMEN1
SCHEMBL6841416 0.77 RAB9A (0.44) RAB9ANPC1SMN1; SMN2HTTPOLB
SCHEMBL6841347 0.77 KCNK3 (0.42) RAB9ANPC1SMN1; SMN2POLBMEN1
SCHEMBL23844181 0.76 BRAF (0.58) RAB9ABRAFNPC1SMN1; SMN2HTT
SCHEMBL6841481 0.76 KMT2A (0.57) RAB9ANPC1SMN1; SMN2HTTTP53
SCHEMBL5490431 0.75 RAB9A (0.66) RAB9ANPC1SMN1; SMN2HTTTP53
SCHEMBL6841303 0.75 BRAF (0.46) RAB9ABRAFNPC1SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092747-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BENDER STEVEN LEE (US) 2004-05-13 US claimed
EP-1252146-A1 AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2002-10-30 EP claimed
US-20020103203-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. 2002-08-01 US claimed
WO-2001053274-A1 AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2001-07-26 WO claimed
US-20040092747-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BENDER STEVEN LEE (US) 2004-05-13 US disclosed
US-6635641-B2 For treating cancer and other disease states associated with unwanted angiogenesis and/or cellular proliferation such as diabetic retinopathy, neovascular glaucoma, rheumatoid arthritis, psoriasis AGOURON PHARMACEUTICALS, INC. 2003-10-21 US disclosed
EP-1252146-A1 AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2002-10-30 EP disclosed
US-20020103203-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. 2002-08-01 US disclosed
WO-2001053274-A1 AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2001-07-26 WO 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 (2 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-20040092747-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BRAF, CNKSR1, UACA RAB9A 1183/4885BRAF 1/4885NAMPT 1253/4885
US-20020103203-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BRAF, CNKSR1, UACA RAB9A 1183/4885BRAF 1/4885NAMPT 1253/4885

“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.