SCHEMBL4007803

SCHEMBL4007803

CCN(CC)c1ccc(Cl)c2c1C(=O)OC21c2ccccc2Oc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.38
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
BRCA1 P38398 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SMAD3 P84022 2/20 0.32
FTO Q9C0B1 2/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
HTT P42858 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
PRMT1 Q99873 1/20 0.32
ACE2 Q9BYF1 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL10481145 0.90 HPGD (0.36) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL2841971 0.90 CYP3A4 (0.41) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL11792853 0.85 CYP3A4 (0.38) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL4379777 0.85 CYP3A4 (0.35) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL10447181 0.84 PGR (0.38) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL9850159 0.83 CYP3A4 (0.39) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL8657937 0.83 ALDH1A1 (0.42) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL9442975 0.83 CYP3A4 (0.37) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL4235431 0.83 CYP3A4 (0.41) CYP3A4HPGDALDH1A1CYP2C9ALOX15
SCHEMBL10585257 0.83 CYP3A4 (0.35) CYP3A4HPGDALDH1A1CYP2C9ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-58059097-A None JP disclosed
EP-2069866-A2 PHOTOCURABLE COMPOSITIONS Ciba Holding Inc. (CH) 2009-06-17 EP disclosed
WO-2008040650-A2 PHOTOCURABLE COMPOSITIONS COMPRISING A PHOTOINITIATOR OF THE PHENYLGLYOXYLATE TYPE CIBA HOLDING INC. (CH) 2008-04-10 WO disclosed
EP-0410042-A1 Lighting lamp TOMOEGAWA PAPER CO. LTD. (JP) 1991-01-30 EP disclosed
EP-0405363-A2 Heat-sensitive recording material NEW OJI PAPER CO., LTD. (JP) 1991-01-02 EP disclosed
EP-0344705-A2 Heat-sensitive recording material KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1989-12-06 EP disclosed
EP-0338587-A2 Recording material KAO CORPORATION (JP) 1989-10-25 EP disclosed
EP-0304936-A2 Heat sensitive paper Kao Corporation (JP) 1989-03-01 EP disclosed
US-4501809-A Photosetting microcapsules and photo- and pressure-sensitive recording sheet MITSUBISHI PAPER MILLS, LTD. (JP) 1985-02-26 US disclosed
JP-S5859097-A TWO-COLOR TYPE HEAT-SENSITIVE RECORDING MATERIAL RICOH CO LTD 1983-04-07 JP disclosed
EP-0056281-A1 Heat-sensitive recording materials KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1982-07-21 EP disclosed