SCHEMBL21574252

SCHEMBL21574252

C=C/C=C(\C=C/C)N(c1ccccc1)c1ncccn1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 2/20 0.31
▸ NPSR1 Q6W5P4 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
SCHEMBL15499533 0.88 NPSR1 (0.36) TRPM8NPSR1
SCHEMBL21577623 0.82 TRPM8 (0.33) TRPM8NPSR1
SCHEMBL19752474 0.81 TRPM8 (0.43) TRPM8NPSR1
SCHEMBL21574238 0.79 NPSR1 (0.31) NPSR1
SCHEMBL20979966 0.78 ALDH1A1 (0.32) TRPM8NPSR1
SCHEMBL24302066 0.78 TRPM8 (0.41) TRPM8NPSR1
SCHEMBL18903960 0.78 KDM4E (0.33) TRPM8NPSR1
SCHEMBL20172600 0.78 FAAH (0.32) —
SCHEMBL21165068 0.77 TRPM8 (0.32) TRPM8
SCHEMBL20684573 0.76 FAAH (0.42) —

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
EP-3303304-B1 METHODS OF MAKING PROTEIN DEACETYLASE INHIBITORS ACETYLON PHARMACEUTICALS INC (US) 2019-11-20 — — EP disclosed
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