SCHEMBL4474686

SCHEMBL4474686

Cc1c(C(N)=O)cc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 10/20 0.62
OPRL1 P41146 1/20 0.48
NOTUM Q6P988 1/20 0.48
CNR1 P21554 6/20 0.47
CNR2 P34972 5/20 0.47
ALDH1A1 P00352 1/20 0.46
CYP2D6 P10635 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
SCHEMBL4465707 0.88 NOTUM (0.63) CHRNA7OPRL1NOTUMCNR1CNR2
SCHEMBL4492901 0.83 MAPK1 (0.67) CHRNA7OPRL1CNR1CNR2ALDH1A1
SCHEMBL5922313 0.82 CHRNA7 (0.56) CHRNA7NOTUMALDH1A1
SCHEMBL5922354 0.81 CHRNA7 (0.61) CHRNA7OPRL1CNR1CNR2
SCHEMBL5922302 0.80 MAPT (0.63) CHRNA7OPRL1NOTUMCNR1CNR2
SCHEMBL5922340 0.79 CHRNA7 (0.54) CHRNA7NOTUMCNR1CNR2ALDH1A1
SCHEMBL28017620 0.79 NOTUM (0.74) NOTUMALDH1A1
SCHEMBL5922332 0.78 CNR1 (0.67) CNR1CNR2
SCHEMBL4918783 0.77 MAPK1 (0.60) CHRNA7OPRL1CNR1CNR2ALDH1A1
SCHEMBL4484123 0.76 NOTUM (0.54) CHRNA7NOTUMCNR1CNR2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524971-B2 1,5-diarylpyrrole derivatives, preparation method thereof and application of same in therapeutics SANOFI - AVENTIS (FR) 2009-04-28 US disclosed
US-20080015245-A1 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2008-01-17 US disclosed
EP-1853557-A2 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2007-11-14 EP disclosed
WO-2006087476-A2 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2006-08-24 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-20080015245-A1 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS QDPR, DPYD, CD38 CHRNA7 3779/4885OPRL1 1286/4885NOTUM 1296/4885

“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.