SCHEMBL2152425

SCHEMBL2152425

CC(N)(C#N)C1Cc2ccccc2O1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.36
AOC2 O75106 5/20 0.35
MAOA P21397 5/20 0.35
MAOB P27338 5/20 0.35
DAO P14920 1/20 0.35
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
CHRM5 P08912 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
HIF1A Q16665 2/20 0.33
NISCH Q9Y2I1 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
CREBBP Q92793 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 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
SCHEMBL8035974 0.82 AOC2 (0.40) SSTR4AOC2MAOAMAOBDAO
SCHEMBL2152307 0.80 PNMT (0.35)
SCHEMBL2152350 0.80 PBRM1 (0.35) HIF1AHPGD
SCHEMBL11952613 0.78 SSTR4 (0.41) SSTR4AOC2MAOAMAOBDAO
SCHEMBL10877666 0.75 HIF1A (0.52) SSTR4HIF1AHPGD
SCHEMBL12911435 0.74 MAOA (0.41) SSTR4AOC2MAOAMAOBDAO
SCHEMBL10366394 0.72 HIF1A (0.38) SSTR4AOC2MAOAMAOBDAO
SCHEMBL7279348 0.71 SSTR4 (0.45) SSTR4AOC2MAOAMAOBDAO
SCHEMBL16252911 0.69 SSTR4 (0.49) SSTR4CHRM2CHRM4CHRM5CHRM1
SCHEMBL8036060 0.69 SSTR4 (0.43) SSTR4AOC2MAOAMAOBDAO

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-2125766-B1 BENZOFURAN ANTIPARASITIC AGENTS PFIZER LTD (GB) 2011-07-06 EP disclosed