SCHEMBL1665511

SCHEMBL1665511

NC(=O)OC(Cc1ccncc1)c1ccccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.40
CRHR1 P34998 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRL1 P41146 1/20 0.40
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK14 Q16539 1/20 0.38
CYP3A4 P08684 2/20 0.37
ALDH1A1 P00352 1/20 0.37
AVPR2 P30518 3/20 0.37
AVPR1A P37288 3/20 0.37
ROCK2 O75116 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL3815968 0.79 CASP1 (0.39) MAPTMEN1KMT2AAVPR2AVPR1A
SCHEMBL255995 0.79 NISCH (0.44) AVPR2AVPR1A
SCHEMBL19236084 0.78 CASP1 (0.44) KMT2AALDH1A1AVPR2AVPR1A
SCHEMBL4312053 0.77 AVPR2 (0.42) OPRM1OPRL1AVPR2AVPR1A
SCHEMBL13667367 0.77 AVPR2 (0.42) OPRM1OPRL1AVPR2AVPR1A
SCHEMBL13667366 0.77 AVPR2 (0.42) OPRM1OPRL1AVPR2AVPR1A
SCHEMBL8741030 0.77 CYP1A2 (0.46) NPSR1LMNASMN1; SMN2AVPR2AVPR1A
SCHEMBL28990562 0.77 MAPT (0.38) MAPTMEN1KMT2AAVPR2AVPR1A
SCHEMBL12561078 0.77 CYP1A2 (0.46) NPSR1LMNASMN1; SMN2AVPR2AVPR1A
SCHEMBL4317565 0.76 AVPR2 (0.42) AVPR2AVPR1A

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
EP-2313094-A1 NEW PYRIDINE DERIVATIVES AS LEPTIN RECEPTOR MODULATOR MIMETICS AstraZeneca AB (SE) 2011-04-27 EP claimed
WO-2009147216-A1 NEW PYRIDINE DERIVATIVES AS LEPTIN RECEPTOR MODULATOR MIMETICS BIOVITRUM AB (PUBL) (SE) 2009-12-10 WO claimed
EP-2313094-A1 NEW PYRIDINE DERIVATIVES AS LEPTIN RECEPTOR MODULATOR MIMETICS AstraZeneca AB (SE) 2011-04-27 EP disclosed
WO-2009147216-A1 NEW PYRIDINE DERIVATIVES AS LEPTIN RECEPTOR MODULATOR MIMETICS BIOVITRUM AB (PUBL) (SE) 2009-12-10 WO disclosed