SCHEMBL14614770

SCHEMBL14614770

CSCCN(C)Cc1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

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
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45
TSHR P16473 1/20 0.45
RECQL P46063 1/20 0.45
RIPK1 Q13546 1/20 0.43
PRMT1 Q99873 3/20 0.43
SIGMAR1 Q99720 2/20 0.43
CARM1 Q86X55 2/20 0.43
TMEM97 Q5BJF2 1/20 0.43
ATM Q13315 1/20 0.42
PNMT P11086 1/20 0.42

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
SCHEMBL15308498 0.81 PYCR1 (0.61) PYCR1TAAR1AOC3ACHEALDH1A1
SCHEMBL21902241 0.80 CARM1 (0.62) PYCR1TAAR1AOC3ACHETSHR
SCHEMBL30093221 0.79 PYCR1 (0.67) PYCR1TAAR1AOC3ACHEALDH1A1
SCHEMBL26655848 0.79 TSHR (0.48) PYCR1TAAR1AOC3KDM4ETSHR
SCHEMBL14149935 0.79 PYCR1 (0.58) PYCR1TAAR1AOC3ACHEALDH1A1
SCHEMBL10294677 0.78 PYCR1 (0.65) PYCR1TAAR1AOC3ACHEALDH1A1
SCHEMBL14614616 0.77 PYCR1 (0.56) PYCR1TAAR1AOC3ACHETSHR
SCHEMBL21726756 0.77 TAAR1 (0.59) TAAR1AOC3PNMT
SCHEMBL11932507 0.75 TSHR (0.54) PYCR1TAAR1AOC3ACHETSHR
SCHEMBL12992972 0.75 PYCR1 (0.54) PYCR1TAAR1AOC3ACHEKDM4E

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