SCHEMBL976277

SCHEMBL976277

Cc1cc2ncc(NC(=O)c3cc4cc(F)ccc4n3Cc3cccc(F)c3)cn2n1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.45
KIT P10721 2/20 0.44
BRAF P15056 2/20 0.44
ECE1 P42892 3/20 0.44
PTGDR2 Q9Y5Y4 3/20 0.41
FSCN1 Q16658 1/20 0.41
MAOB P27338 1/20 0.41
SCD O00767 3/20 0.40
SCD5 Q86SK9 3/20 0.40
CCR2 P41597 1/20 0.40
ABCB1 P08183 1/20 0.40

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
SCHEMBL974021 0.81 ECE1 (0.49) F10ECE1PTGDR2MAOBSCD
SCHEMBL973614 0.81 ECE1 (0.47) F10ECE1PTGDR2CCR2ABCB1
SCHEMBL974865 0.81 F10 (0.44) F10ECE1MAOBSCDSCD5
SCHEMBL977067 0.80 ECE1 (0.46) F10ECE1PTGDR2MAOBCCR2
SCHEMBL4145769 0.79 ECE1 (0.51) F10ECE1PTGDR2MAOBCCR2
SCHEMBL974519 0.79 ECE1 (0.58) F10ECE1PTGDR2MAOBCCR2
SCHEMBL2900723 0.79 ECE1 (0.58) F10ECE1MAOBSCDSCD5
SCHEMBL4145734 0.79 F10 (0.46) F10ECE1PTGDR2MAOBCCR2
SCHEMBL975576 0.79 ECE1 (0.47) F10ECE1PTGDR2MAOBCCR2
SCHEMBL4150411 0.79 F10 (0.47) F10ECE1PTGDR2MAOBCCR2

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-2235016-B1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-09-18 EP claimed
US-8394820-B2 N-azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-03-12 US claimed
US-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-13 US claimed
EP-2235016-B1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-09-18 EP disclosed
US-8394820-B2 N-azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-03-12 US disclosed
US-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-13 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 (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-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF XDH, NQO2, SLC28A2 F10 2006/4885KIT 2203/4885BRAF 1477/4885

“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.