SCHEMBL27980753

SCHEMBL27980753

CCCCCc1c(C)cccc1Oc1ccccc1O

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.45
▸ PTGS2 P35354 1/20 0.45
▸ CNR1 P21554 4/20 0.42
▸ CNR2 P34972 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
SCHEMBL27980992 0.90 LMNA (0.42) —
SCHEMBL983295 0.86 ALOX5 (0.55) ALOX5PTGS2
SCHEMBL984426 0.85 ALOX5 (0.54) ALOX5PTGS2
SCHEMBL983345 0.85 ALOX5 (0.54) ALOX5PTGS2
SCHEMBL982321 0.85 ALOX5 (0.54) ALOX5PTGS2
SCHEMBL984004 0.85 ALOX5 (0.54) ALOX5PTGS2
SCHEMBL982036 0.85 ALOX5 (0.54) ALOX5PTGS2
SCHEMBL985999 0.85 ALOX5 (0.54) ALOX5PTGS2
SCHEMBL28785460 0.83 ALOX5 (0.40) ALOX5PTGS2
SCHEMBL29398117 0.81 BID (0.47) PTGS2

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
CN-102471244-B Process for producing N-substituted carbamate, process for producing isocyanate using the N-substituted carbamate, and composition for transporting and storing N-substituted carbamate containing N-substituted carbamate and aromatic hydroxy compound ASAHI CHEMICAL CORP 2014-09-24 — — CN disclosed
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