SCHEMBL10990332

SCHEMBL10990332

CCC(C)NC(=O)c1nc(-c2ccccc2)c2ccccc2n1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TACR3 P29371 2/20 0.51

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
SCHEMBL16156360 0.85 TACR3 (0.54) TACR3
SCHEMBL16156359 0.84 TSPO (0.52) —
SCHEMBL12749845 0.81 SCN9A (0.52) —
SCHEMBL10985666 0.79 MEN1 (0.49) —
SCHEMBL10749116 0.77 SCN9A (0.57) —
SCHEMBL14281527 0.76 TACR3 (0.58) TACR3
SCHEMBL13585802 0.75 CYP3A4 (0.56) —
SCHEMBL21606345 0.75 MEN1 (0.50) TACR3
SCHEMBL28619828 0.73 TSPO (0.50) —
SCHEMBL28619827 0.73 TSPO (0.50) —

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-4499094-A PREVENTION OF RESPIRATORY, UROGENITAL, CARDIOVASCULAR AND IMMUNOLOGICAL DISORDERS WHEN USING FOR BENZDIAPINES PHARMUKA LABORATOIRES (FR) 1985-02-12 — — US disclosed
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