SCHEMBL8952319

SCHEMBL8952319

O=CNCCCCCC1CCCCCC1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.60
ADH1B P00325 3/20 0.55
ADH1C P00326 3/20 0.55
ADH1A P07327 3/20 0.55
ADH7 P40394 3/20 0.55
ADH4 P08319 2/20 0.55
EPHX1 P07099 2/20 0.43
CYP1A2 P05177 1/20 0.43
KDM5A P29375 3/20 0.41
PHF8 Q9UPP1 3/20 0.41
KDM2A Q9Y2K7 3/20 0.41
KDM4C Q9H3R0 2/20 0.41
KDM4A O75164 1/20 0.41
ADAMTS4 O75173 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
GPR84 Q9NQS5 1/20 0.39
LMNA P02545 1/20 0.38
NAAA Q02083 1/20 0.38

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
SCHEMBL8861073 1.00 SIGMAR1 (0.60) SIGMAR1ADH1BADH1CADH1AADH7
SCHEMBL303075 0.98 ADH1B (0.57) SIGMAR1ADH1BADH1CADH1AADH7
SCHEMBL22104300 0.96 ADH1B (0.54) SIGMAR1ADH1BADH1CADH1AADH7
SCHEMBL304406 0.94 ADH1B (0.57) SIGMAR1ADH1BADH1CADH1AADH7
SCHEMBL3024930 0.92 ADH1B (0.54) SIGMAR1ADH1BADH1CADH1AADH7
SCHEMBL5646910 0.85 ADH1B (0.61) SIGMAR1ADH1BADH1CADH1AADH7
SCHEMBL302803 0.85 ADH1B (0.61) SIGMAR1ADH1BADH1CADH1AADH7
SCHEMBL5651899 0.83
SCHEMBL5649841 0.83 ADH1B (0.58) SIGMAR1ADH1BADH1CADH1AADH7
SCHEMBL10684366 0.79 SIGMAR1 (0.54) SIGMAR1ADH1BADH1CADH1AADH7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506239-A Carbostyril derivative and platelets aggregation inhibitory agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-04-09 US disclosed
EP-0569592-A1 CARBOSTYRIL DERIVATIVE AND PLATELET AGGLUTINATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-11-18 EP disclosed