SCHEMBL9750099

SCHEMBL9750099

CCCCC(CC)C(c1ccc(N(Cc2ccccc2)Cc2ccccc2)cc1)c1ccc(N(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.47
▸ TSHR P16473 1/20 0.45
▸ NR1H2 P55055 3/20 0.42
▸ NR1H3 Q13133 3/20 0.42
▸ CNR2 P34972 13/20 0.42
▸ CNR1 P21554 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35

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
SCHEMBL10775309 0.84 CYP2C19 (0.54) CYP2C19TSHRNR1H2NR1H3CNR2
SCHEMBL11106441 0.82 CNR2 (0.46) TSHRCNR2CNR1KDM4EALDH1A1
SCHEMBL10781389 0.81 MAPT (0.44) TSHRCNR2ALDH1A1
SCHEMBL8086502 0.80 ALDH1A1 (0.49) CNR2KDM4EALDH1A1
SCHEMBL10951456 0.80 CYP2C19 (0.53) CYP2C19TSHRNR1H2NR1H3CNR2
SCHEMBL9750090 0.79 TSHR (0.39) CYP2C19TSHRNR1H2NR1H3CNR2
SCHEMBL10778591 0.78 CYP2C19 (0.51) CYP2C19TSHRNR1H2NR1H3CNR2
SCHEMBL10778766 0.78 CYP2C19 (0.54) CYP2C19TSHRNR1H2NR1H3CNR2
SCHEMBL9619470 0.77 CYP2C19 (0.58) CYP2C19TSHRNR1H2NR1H3CNR2
SCHEMBL51810 0.77 CYP2C19 (0.61) CYP2C19TSHRNR1H2NR1H3CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5118986-A Electroluminescent device RICOH COMPANY, LTD. (JP) 1992-06-02 — — US claimed
EP-0115198-B1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTIVE ELEMENTS TOMOEGAWA PAPER MANUFACTURING COMPANY LIMITED (JP) 1987-03-11 — — EP disclosed
US-4539282-A SENSITIZED ZINC OXIDE, POLYCARBONATE BINDER AND AROMATIC DIAMINE TOMOEGAWA PAPER MANUFACTURING COMPANY LIMITED (JP) 1985-09-03 — — US disclosed
EP-0115198-A1 Electrophotographic photoconductive elements TOMOEGAWA PAPER MANUFACTURING COMPANY LIMITED (JP) 1984-08-08 — — EP disclosed
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