SCHEMBL21574238

SCHEMBL21574238

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

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ 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
SCHEMBL18400777 0.88 NPSR1 (0.36) NPSR1
SCHEMBL27116535 0.87 PTGIR (0.34) NPSR1
SCHEMBL16500988 0.81 NPSR1 (0.34) NPSR1
SCHEMBL11932372 0.81 TRPM8 (0.40) NPSR1
SCHEMBL21574252 0.79 TRPM8 (0.31) NPSR1
SCHEMBL23280814 0.78 CYP3A4 (0.35) NPSR1
SCHEMBL20814556 0.77 TRPM8 (0.38) —
SCHEMBL13177385 0.77 ALDH1A1 (0.36) —
SCHEMBL20433997 0.76 FAAH (0.42) —
SCHEMBL10071338 0.76 — —

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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