SCHEMBL7467175

SCHEMBL7467175

COC(=O)c1cc(OCc2nc(C(C)(C)C)cs2)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 3/20 0.44
HSP90AA1 P07900 1/20 0.42
KMT2A Q03164 1/20 0.40
BCHE P06276 1/20 0.40
PPARD Q03181 2/20 0.39
ALOX5AP P20292 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.38
MAOB P27338 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PPARA Q07869 1/20 0.38
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CCNA1 P78396 1/20 0.37
CDK5 Q00535 1/20 0.37

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
SCHEMBL7477249 0.89 MAPT (0.46) MAPTNPC1RAB9AHSP90AA1KMT2A
SCHEMBL7473467 0.80 NPC1 (0.45) MAPTNPC1RAB9AKMT2AALDH1A1
SCHEMBL27478197 0.80 CYSLTR1 (0.52) MAPTBCHEPPARDPPARATP53
SCHEMBL7471878 0.79 MAPT (0.53) MAPTNPC1RAB9AHSP90AA1KMT2A
SCHEMBL7471233 0.73 NPC1 (0.44) MAPTNPC1RAB9AKMT2AALDH1A1
SCHEMBL7470170 0.73 NR4A2 (0.56) NPC1RAB9AKMT2APPARD
SCHEMBL7470761 0.73 MAPT (0.42) MAPTNPC1RAB9AHSP90AA1KMT2A
SCHEMBL7467705 0.72 MAPT (0.46) MAPTNPC1RAB9AKMT2AALDH1A1
SCHEMBL7473893 0.72 NOTUM (0.44) MAPTNPC1RAB9AHSP90AA1KMT2A
SCHEMBL7469540 0.72 MAPT (0.55) MAPTNPC1RAB9AKMT2ABCHE

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-0786457-B1 AZOLE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2002-05-29 EP disclosed
US-5981559-A USEFUL IN PREVENTING OR TREATING ALLERGIC DISEASES, ISCHEMIC HEART DISEASES OR ISCHEMIC BRAIN DISEASES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1999-11-09 US disclosed
EP-0786457-A1 AZOLE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1997-07-30 EP disclosed