SCHEMBL3986557

SCHEMBL3986557

CNC(=O)c1cc(Oc2cccc(CCNC(=O)c3ccc(OC)c(F)c3)c2)ccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.49
BRAF P15056 3/20 0.48
RAF1 P04049 2/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
ROCK2 O75116 2/20 0.47
ROCK1 Q13464 2/20 0.47
KDR P35968 4/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
POLB P06746 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPK1 P28482 1/20 0.43
DDR2 Q16832 1/20 0.43

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
SCHEMBL14266595 0.92 RAB9A (0.58) CSF1RBRAFRAF1RAB9ANPC1
SCHEMBL14266592 0.91 BRAF (0.51) CSF1RBRAFRAF1RAB9AKDR
SCHEMBL5123404 0.90 DDR2 (0.49) CSF1RBRAFRAF1RAB9ANPC1
SCHEMBL14273319 0.90 BRAF (0.52) CSF1RBRAFRAF1RAB9ANPC1
SCHEMBL3989035 0.89 BRAF (0.49) CSF1RBRAFRAF1RAB9AKDR
SCHEMBL14266541 0.89 RAF1 (0.56) CSF1RBRAFRAF1RAB9ANPC1
SCHEMBL3985600 0.88 BRAF (0.49) CSF1RBRAFRAF1RAB9AKDR
SCHEMBL4289196 0.87 RAB9A (0.55) CSF1RBRAFRAF1RAB9AROCK2
SCHEMBL3986441 0.87 RAB9A (0.55) CSF1RBRAFRAF1RAB9ANPC1
SCHEMBL14266605 0.87 BRAF (0.55) CSF1RBRAFRAF1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2061761-A1 PHENETHYLAMIDE DERIVATIVES WITH KINASE INHIBITORY ACTIVITY Millennium Pharmaceuticals, Inc. (US) 2009-05-27 EP disclosed
US-20080064729-A1 Phenethylamide derivatives with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-03-13 US disclosed
US-20080064729-A1 Phenethylamide derivatives with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-03-13 US disclosed
US-20080064729-A1 Phenethylamide derivatives with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-03-13 US disclosed
WO-2008030448-A1 PHENETHYLAMIDE DERIVATIVES WITH KINASE INHIBITORY ACTIVITY MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-03-13 WO disclosed
WO-2008030448-A1 PHENETHYLAMIDE DERIVATIVES WITH KINASE INHIBITORY ACTIVITY MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-03-13 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 (1 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-20080064729-A1 Phenethylamide derivatives with kinase inhibitory activity MAP4K5, MAP3K5, MAP4K2 CSF1R 2904/4885BRAF 242/4885RAF1 251/4885

“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.