SCHEMBL10057523

SCHEMBL10057523

CCCCCC1CC1CC1C[C@@H]1C[C@@H]1CC1CC1CC1CCCC(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.58
TSHR P16473 3/20 0.44
TRPV1 Q8NER1 2/20 0.41
PRKCA P17252 2/20 0.41
PRKCE Q02156 2/20 0.41
HPSE Q9Y251 1/20 0.40
CA12 O43570 2/20 0.40
CA14 Q9ULX7 2/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
EPHX2 P34913 1/20 0.39
NAAA Q02083 2/20 0.38
POLB P06746 1/20 0.38
POLA1 P09884 1/20 0.38
DGKA P23743 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 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
SCHEMBL3425777 1.00 ALOX5 (0.58) ALOX5TSHRTRPV1PRKCAPRKCE
SCHEMBL10058627 1.00 ALOX5 (0.58) ALOX5TSHRTRPV1PRKCAPRKCE
SCHEMBL4813968 0.95 ALOX5 (0.57) ALOX5TSHRTRPV1PRKCAPRKCE
Cyclopropane SCHEMBL20558634 0.92 ALOX5 (0.54) ALOX5TSHRTRPV1PRKCAPRKCE
SCHEMBL10085305 0.90 ALOX5 (0.62) ALOX5TSHRTRPV1HPSECA12
SCHEMBL16174233 0.90 ALOX5 (0.62) ALOX5TSHRTRPV1HPSECA12
SCHEMBL2505317 0.90 ALOX5 (0.62) ALOX5TSHRTRPV1HPSECA12
SCHEMBL31039608 0.90 ALOX5 (0.62) ALOX5TSHRTRPV1HPSECA12
SCHEMBL2508699 0.90 ALOX5 (0.62) ALOX5TSHRTRPV1HPSECA12
SCHEMBL2505318 0.90 ALOX5 (0.62) ALOX5TSHRTRPV1HPSECA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012006510-A1 FATTY ACID PROTEIN KINASE C ACTIVATORS AND ANTICOAGULANT FOR THE TREATMENT OF STROKE ALKON DANIEL L (US) 2012-01-12 WO disclosed