SCHEMBL11206145

SCHEMBL11206145

CCc1cccc(C=Cc2c[nH]cn2)c1CC

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.36
HTR1A P08908 1/20 0.36
GABRA1 P14867 2/20 0.30
GABRB2 P47870 2/20 0.30

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
SCHEMBL11214569 0.82 GABRA1 (0.33) TAAR1HTR1AGABRA1GABRB2
SCHEMBL11211231 0.81 TAAR1 (0.37) TAAR1HTR1AGABRA1GABRB2
SCHEMBL11208533 0.80 TAAR1 (0.34) TAAR1HTR1A
SCHEMBL5528070 0.74 GABRA1 (0.40) TAAR1HTR1AGABRA1GABRB2
SCHEMBL11208205 0.74 HDAC4 (0.37)
SCHEMBL11206134 0.73 RAB9A (0.33)
SCHEMBL29952858 0.72 KMT2A (0.45)
SCHEMBL2559134 0.72 KMT2A (0.45)
SCHEMBL2559133 0.72 KMT2A (0.45)
SCHEMBL11215662 0.71 GABRA1 (0.40) TAAR1HTR1AGABRA1GABRB2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0034474-B1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Farmos-Yhtyma Oy (FI) 1983-01-26 EP disclosed
US-4333947-A HYPOTENSIVE AGENTS, BACTERICIDES, FUNGICIDES FARMOS-YHTYMA OY (FI) 1982-06-08 US disclosed