SCHEMBL974569

SCHEMBL974569

Cc1nc2cc(NC(=O)c3cc4cc(C(F)(F)F)ccc4n3Cc3cccc(F)c3)ccn2c1C

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 2/20 0.44
PPARG P37231 11/20 0.44
CCR2 P41597 1/20 0.41
PTGDR2 Q9Y5Y4 3/20 0.40
F10 P00742 2/20 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
SCHEMBL975576 0.93 ECE1 (0.47) ECE1CCR2PTGDR2F10
SCHEMBL973777 0.88 LMNA (0.38) ECE1PPARG
SCHEMBL974067 0.83 ECE1 (0.47) ECE1CCR2PTGDR2F10
SCHEMBL974090 0.82 PPARG (0.43) ECE1PPARGCCR2
SCHEMBL974068 0.81 KDM4E (0.42) ECE1PPARGCCR2F10
SCHEMBL4656151 0.81 PPARG (0.49) ECE1PPARGCCR2
SCHEMBL973614 0.81 ECE1 (0.47) ECE1CCR2PTGDR2F10
SCHEMBL832765 0.80 ECE1 (0.44) ECE1PPARGCCR2PTGDR2F10
SCHEMBL977067 0.80 ECE1 (0.46) ECE1CCR2PTGDR2F10
SCHEMBL3149353 0.80 ECE1 (0.48) ECE1PPARGCCR2

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 10 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
CN-101977910-B Azabicyclic carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS 2013-08-07 CN claimed
US-8394820-B2 N-azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-03-12 US claimed
CN-101977910-A Azabicyclic carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS 2011-02-16 CN 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
CN-101977910-B Azabicyclic carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS 2013-08-07 CN disclosed
US-8394820-B2 N-azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-03-12 US disclosed
CN-101977910-A Azabicyclic carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS 2011-02-16 CN 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 3013/4885PPARG 1906/4885CCR2 2204/4885

“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.