SCHEMBL4911902

SCHEMBL4911902

Cc1nc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2Cl)cc1CO

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.43
CNR1 P21554 5/20 0.43
HSD11B1 P28845 1/20 0.43
CRHR1 P34998 3/20 0.42
DPP4 P27487 1/20 0.41
DPP8 Q6V1X1 1/20 0.41

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
SCHEMBL15392785 0.89 DPP4 (0.47) MALT1CNR1CRHR1DPP4DPP8
SCHEMBL4911607 0.88 HSD11B1 (0.43) MALT1HSD11B1CRHR1DPP4DPP8
SCHEMBL4934709 0.86 DPP4 (0.48) HSD11B1DPP4DPP8
Hydrochloric Acid SCHEMBL4918479 0.85 DPP4 (0.47) HSD11B1DPP4DPP8
SCHEMBL5187409 0.80 DPP4 (0.44) CRHR1DPP4DPP8
SCHEMBL15392959 0.79 MALT1 (0.44) MALT1CNR1DPP4
Hydrochloric Acid SCHEMBL4913608 0.79 DPP4 (0.43) CRHR1DPP4DPP8
SCHEMBL5202471 0.78 DPP4 (0.55) CNR1CRHR1DPP4DPP8
SCHEMBL3889534 0.77 CNR1 (0.50) CNR1DPP4DPP8
Hydrochloric Acid SCHEMBL4912438 0.77 DPP4 (0.54) CNR1CRHR1DPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080021070-A1 PYRIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2008-01-24 US disclosed
EP-1805143-A1 PYRIDINE DERIVATIVES AND THE PREPARATION AND THE THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-07-11 EP disclosed
WO-2006042955-A1 PYRIDINE DERIVATIVES AND THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2006-04-27 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-20080021070-A1 PYRIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF CNR1, CNR2, GPR18 MALT1 1639/4885CNR1 1/4885HSD11B1 2281/4885

“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.