SCHEMBL7957685

SCHEMBL7957685

NCCc1ccsc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 11/20 0.44
MAOB P27338 4/20 0.39
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
MPO P05164 1/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL10947030 0.75
SCHEMBL12322155 0.75 GABRA1 (0.33)
SCHEMBL11069914 0.74 IDO1 (0.47)
SCHEMBL10568488 0.71 RXRA (0.33)
SCHEMBL29049113 0.69 CALM1 (0.39) HTR2A
SCHEMBL2307732 0.68
SCHEMBL4454381 0.68
SCHEMBL16938728 0.68
SCHEMBL2985299 0.68
SCHEMBL18049547 0.67 L3MBTL1 (0.33)

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
WO-2001009127-A1 BENZOXAZINE DERIVATIVES AND THEIR THERAPEUTIC USE AVENTIS PHARMA S.A. (FR) 2001-02-08 WO disclosed