SCHEMBL14614616

SCHEMBL14614616

COCCN(C)Cc1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.56
TAAR1 Q96RJ0 1/20 0.51
AOC3 Q16853 1/20 0.49
ACHE P22303 4/20 0.48
CARM1 Q86X55 2/20 0.46
PRMT1 Q99873 2/20 0.46
SIGMAR1 Q99720 2/20 0.46
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
TSHR P16473 2/20 0.45
RECQL P46063 1/20 0.45
BCHE P06276 1/20 0.45
RIPK1 Q13546 1/20 0.43

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
SCHEMBL12992972 0.91 PYCR1 (0.54) PYCR1TAAR1AOC3ACHECARM1
SCHEMBL14174811 0.82 CYP2D6 (0.54) TAAR1ACHETSHRRECQL
SCHEMBL13362520 0.82 TSHR (0.45) ACHECARM1SIGMAR1SMN1; SMN2TSHR
SCHEMBL15308498 0.81 PYCR1 (0.61) PYCR1TAAR1AOC3ACHECARM1
SCHEMBL13232635 0.81 TAAR1 (0.51) TAAR1SIGMAR1TSHRRIPK1
SCHEMBL21902241 0.80 CARM1 (0.62) PYCR1TAAR1AOC3ACHECARM1
SCHEMBL16549287 0.80 MEN1 (0.52) PYCR1AOC3ACHESIGMAR1GAA
SCHEMBL615516 0.79 TSHR (0.65) CARM1SIGMAR1SMN1; SMN2TSHR
SCHEMBL30093221 0.79 PYCR1 (0.67) PYCR1TAAR1AOC3ACHEGAA
SCHEMBL14149935 0.79 PYCR1 (0.58) PYCR1TAAR1AOC3ACHESIGMAR1

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-1757591-A1 CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2007-02-28 EP disclosed