SCHEMBL974067

SCHEMBL974067

Cc1nc2cc(NC(=O)c3cc4cc(F)ccc4n3Cc3cccc(F)c3)ccn2c1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 7/20 0.47
PTGDR2 Q9Y5Y4 5/20 0.42
F10 P00742 3/20 0.42
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
CCR2 P41597 1/20 0.40
ROCK1 Q13464 1/20 0.39
MAOB P27338 1/20 0.39
ABCB1 P08183 1/20 0.38

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
SCHEMBL975576 0.90 ECE1 (0.47) ECE1PTGDR2F10CCR2MAOB
SCHEMBL832765 0.86 ECE1 (0.44) ECE1PTGDR2F10CCR2ROCK1
SCHEMBL974569 0.83 ECE1 (0.44) ECE1PTGDR2F10CCR2
SCHEMBL977067 0.82 ECE1 (0.46) ECE1PTGDR2F10CCR2MAOB
SCHEMBL973614 0.80 ECE1 (0.47) ECE1PTGDR2F10CCR2ABCB1
SCHEMBL1093763 0.80 F10 (0.41) ECE1PTGDR2F10CCR2MAOB
SCHEMBL829963 0.80 F10 (0.41) ECE1PTGDR2F10CNR2CCR2
SCHEMBL974348 0.79 ECE1 (0.47) ECE1PTGDR2F10CCR2ROCK1
SCHEMBL975637 0.77 F10 (0.43) ECE1PTGDR2F10CNR2CCR2
SCHEMBL14754816 0.77 F10 (0.45) ECE1PTGDR2F10CCR2ABCB1

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 ECE1 3013/4885PTGDR2 2641/4885F10 2006/4885

“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.