SCHEMBL9159976

SCHEMBL9159976

CCc1ccc(CCc2ccc(Cl)nc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
RAB9A P51151 1/20 0.49
ALDH1A1 P00352 1/20 0.46
GAA P10253 2/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 2/20 0.44
TAAR1 Q96RJ0 1/20 0.43

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
SCHEMBL9157673 0.88 ALDH1A1 (0.46) MAPTL3MBTL1RAB9AALDH1A1GAA
SCHEMBL31119455 0.87
SCHEMBL91385 0.87
SCHEMBL9766627 0.86 MAPT (0.43) MAPTL3MBTL1RAB9AALDH1A1GAA
SCHEMBL9158922 0.85 NFKB1 (0.51) MAPTL3MBTL1RAB9AALDH1A1GAA
SCHEMBL6788044 0.83 ALDH1A1 (0.49) MAPTL3MBTL1RAB9AALDH1A1GAA
SCHEMBL9158692 0.83 MAPT (0.49) MAPTL3MBTL1RAB9AALDH1A1GAA
SCHEMBL9154338 0.82 RAB9A (0.50) MAPTL3MBTL1RAB9AALDH1A1KDM4E
SCHEMBL9319296 0.80 MAPT (0.54) MAPTL3MBTL1RAB9AALDH1A1GAA
SCHEMBL9154057 0.80 PIK3CD (0.52) MAPTL3MBTL1RAB9AALDH1A1GAA

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-0445248-B1 PYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 1995-03-08 EP disclosed
US-5205962-A Stable liquid crystals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-04-27 US disclosed
WO-1991004248-A1 PYRIDINE DERIVATIVES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1991-04-04 WO disclosed