SCHEMBL4906797

SCHEMBL4906797

COCc1nc(-c2ccc(OC)cc2)c(-c2ccc(Cl)cc2Cl)cc1CN

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 10/20 0.53
DPP8 Q6V1X1 3/20 0.46
DPP9 Q86TI2 3/20 0.46
CNR1 P21554 2/20 0.42
CNR2 P34972 1/20 0.42
CYP3A4 P08684 2/20 0.41
PTPN1 P18031 1/20 0.40
CXCR2 P25025 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CRHR1 P34998 3/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 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
SCHEMBL3114608 0.93 DPP4 (0.44) DPP4DPP8DPP9CYP3A4CRHR1
SCHEMBL4910547 0.90 DPP4 (0.45) DPP4DPP8DPP9CNR1CNR2
SCHEMBL3102348 0.89 DPP4 (0.41) DPP4DPP8DPP9CYP3A4CRHR1
SCHEMBL5189117 0.89 DPP4 (0.57) DPP4DPP8DPP9CNR1CNR2
SCHEMBL5202471 0.86 DPP4 (0.55) DPP4DPP8DPP9CNR1CNR2
Hydrochloric Acid SCHEMBL4912438 0.85 DPP4 (0.54) DPP4DPP8DPP9CNR1CNR2
SCHEMBL4906770 0.82 PTPN1 (0.47) DPP4CNR1PTPN1MEN1KMT2A
SCHEMBL4912767 0.81 DPP4 (0.52) DPP4DPP8DPP9CNR1CNR2
SCHEMBL3106224 0.80 DPP4 (0.47) DPP4CNR1CNR2CRHR1
SCHEMBL3114685 0.79 CRHR1 (0.38) CNR1MEN1KMT2ACRHR1MAPT

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 DPP4 3899/4885DPP8 4105/4885DPP9 2157/4885

“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.