SCHEMBL9208436

SCHEMBL9208436

CCc1cc(CC(C)Cl)on1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.38
EPHX2 P34913 1/20 0.37
ALDH1A1 P00352 3/20 0.34
NPC1 O15118 3/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 2/20 0.32
PPARA Q07869 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL10154815 0.85 RAB9A (0.46) RAB9AEPHX2ALDH1A1NPC1S1PR1
SCHEMBL9285410 0.78
SCHEMBL2038427 0.76
SCHEMBL11928813 0.73 RAB9A (0.39) RAB9AALDH1A1NPC1S1PR1S1PR3
SCHEMBL10120992 0.72 S1PR1 (0.45) RAB9AALDH1A1NPC1S1PR1S1PR3
SCHEMBL11454209 0.72
SCHEMBL10154648 0.72 PPARA (0.45) RAB9AEPHX2ALDH1A1NPC1S1PR1
SCHEMBL9629469 0.72
SCHEMBL14394814 0.72
SCHEMBL443027 0.72

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-0413289-B1 Oxadiazolyl-phenoxyalkylisoxazoles and their use as antiviral agents STERLING WINTHROP INC (US) 1995-02-01 EP disclosed
US-5175178-A 1,2,4-oxadiazolyl-phenoxyalkylisoxazoles and their use as antiviral agents STERLING DRUG INC. (US) 1992-12-29 US disclosed
US-4942241-A PICORNAVIRUS INCLUDING RHINOVIRUS STERLING DRUG INC. (US) 1990-07-17 US disclosed