SCHEMBL12808642

SCHEMBL12808642

C=C(C)/C=C\C(=C/C)N(c1ccc(C)cc1)c1ccc(C)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ TSHR P16473 1/20 0.34
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ PKM P14618 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ ATM Q13315 2/20 0.31
▸ NPSR1 Q6W5P4 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ NLRP1 Q9C000 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ NTSR1 P30989 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ TGM2 P21980 1/20 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
SCHEMBL16016248 0.89 HCRTR2 (0.34) TRPM8CYP2C9ATMMEN1KMT2A
SCHEMBL12581979 0.81 LMNA (0.37) TRPM8ALDH1A1NPSR1LMNAKMT2A
SCHEMBL21117282 0.81 ESR1 (0.34) ALDH1A1HTTLMNA
SCHEMBL14997039 0.78 — —
SCHEMBL14646321 0.77 ALDH1A1 (0.39) TRPM8ALDH1A1TSHRCYP2C9CYP2C19
SCHEMBL20385070 0.75 TRPM8 (0.49) TRPM8ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL13878906 0.74 TRPM8 (0.39) TRPM8ALDH1A1CYP3A4NPSR1HPGD
SCHEMBL20385009 0.70 TRPM8 (0.44) TRPM8ALDH1A1TSHRCYP2C19HTT
SCHEMBL20182666 0.68 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19PKM
SCHEMBL20390536 0.67 ALDH1A1 (0.35) ALDH1A1TSHRCYP3A4CYP2C9CYP2C19

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-2289966-A1 COPOLYMER AND POLYMER LIGHT-EMITTING ELEMENT USING THE SAME Sumitomo Chemical Company, Limited (JP) 2011-03-02 — — EP disclosed
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