SCHEMBL11261392

SCHEMBL11261392

CCCCc1ccc(CCCC2(Cn3ccnc3)SCC(C)S2)cc1

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 4/20 0.42

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
SCHEMBL11264806 0.94 HMOX1 (0.42) HMOX1
SCHEMBL11261323 0.91 CYP19A1 (0.44) HMOX1
SCHEMBL11255084 0.91 HMOX1 (0.40) HMOX1
SCHEMBL11270291 0.90 HMOX1 (0.51) HMOX1
SCHEMBL11270183 0.90 HMOX1 (0.53) HMOX1
SCHEMBL11258235 0.90 CYP1A2 (0.41) HMOX1
SCHEMBL11260695 0.89 KDM4E (0.46) HMOX1
SCHEMBL10785039 0.89 TBXAS1 (0.41) HMOX1
SCHEMBL11266244 0.89 CYP3A4 (0.46) HMOX1
SCHEMBL11260173 0.88 HMOX1 (0.43) HMOX1

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
US-4359475-A SPERMICIDES, MICROBIOCIDES OR ANTICONVULSANTS SYNTEX (U.S.A.) INC. (US) 1982-11-16 US disclosed