SCHEMBL11657232

SCHEMBL11657232

NCC(N)c1c(I)cccc1I

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.37
HTR2A P28223 1/20 0.32
IDO1 P14902 2/20 0.31
SCN4A P35499 4/20 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
SCHEMBL11080744 0.78 TAAR1 (0.38) TAAR1HTR2AIDO1SCN4A
SCHEMBL11658702 0.76 SCN4A (0.42) TAAR1HTR2ASCN4A
SCHEMBL7151065 0.74 TAAR1 (0.40) TAAR1IDO1
SCHEMBL8518741 0.74 TAAR1 (0.40) TAAR1HTR2AIDO1
SCHEMBL11661173 0.71 HTR2C (0.38) TAAR1HTR2A
SCHEMBL11658725 0.71 TAAR1 (0.37) TAAR1HTR2AIDO1
SCHEMBL11364826 0.71 TAAR1 (0.43) TAAR1IDO1
Hydrochloric Acid SCHEMBL28805848 0.70 TAAR1 (0.35) TAAR1HTR2AIDO1
SCHEMBL5167903 0.68 GABRA1 (0.43) TAAR1SCN4A
SCHEMBL1815884 0.68 GABRA1 (0.43) TAAR1HTR2A

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-4129661-A 4,5-Dihydro-2-lower alkoxycarbonylamino-4-phenylimidazoles and substituted phenyl derivatives thereof SYNTEX (U.S.A.) INC. (US) 1978-12-12 US disclosed