SCHEMBL2361387

SCHEMBL2361387

Cc1cc(OC(=O)O)nn1Cc1ccc(Cl)nc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.62
KMT2A Q03164 4/20 0.43
GAA P10253 1/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
PTGER1 P34995 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 2/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL14638034 0.84 KMT2A (0.49) LMNAKMT2AGAARAB9AMEN1
SCHEMBL2361385 0.81 LMNA (0.67) LMNAKMT2AMEN1ATMPTGER1
SCHEMBL13363517 0.78 LMNA (0.65) LMNAKMT2AGAARAB9AMEN1
SCHEMBL13362271 0.77 LMNA (0.61) LMNAKMT2AGAARAB9AMEN1
SCHEMBL2360064 0.77 LMNA (0.48) LMNAKMT2ARAB9AMEN1ATM
SCHEMBL4683986 0.75 PTGER1 (0.66) PTGER1
SCHEMBL17627074 0.75 LMNA (0.37) LMNAGAARAB9APTGER1HTT
SCHEMBL4684637 0.74 PTGER1 (0.59) PTGER1
SCHEMBL4683882 0.72 PTGER1 (0.61) PTGER1
SCHEMBL4681478 0.72 PTGER1 (0.77) PTGER1

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
EP-2356113-B1 HETEROCYCLICALLY SUBSTITUTED ARYL COMPOUNDS AS HIF INHIBITORS BAYER IP GMBH (DE) 2015-01-07 EP disclosed
EP-2356114-A1 AMINOALKYL-SUBSTITUTED COMPOUNDS AS HIF INHIBITORS Bayer Schering Pharma Aktiengesellschaft (DE) 2011-08-17 EP disclosed
WO-2010054762-A1 AMINOALKYL-SUBSTITUTED COMPOUNDS AS HIF INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-05-20 WO disclosed