SCHEMBL8533780

SCHEMBL8533780

COc1ccc(CCl)cc1C=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
TSHR P16473 2/20 0.50
TUBB1 Q9H4B7 1/20 0.50
KDM4E B2RXH2 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
TTR P02766 2/20 0.49
HPGD P15428 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
ERN1 O75460 4/20 0.43
LMNA P02545 4/20 0.43
MAPT P10636 2/20 0.43
PRKDC P78527 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA2 P00918 1/20 0.41
FDPS P14324 1/20 0.41

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
SCHEMBL29119944 0.86 TUBB1 (0.48) ALDH1A1TSHRTUBB1KDM4ETDP1
SCHEMBL28783867 0.86 ALDH1A1 (0.58) ALDH1A1TSHRTUBB1KDM4ETDP1
SCHEMBL9681414 0.84 ALDH1A1 (0.52) ALDH1A1TSHRTUBB1KDM4ETDP1
SCHEMBL29951235 0.84 ALDH1A1 (0.52) ALDH1A1TSHRTUBB1KDM4ETDP1
SCHEMBL5804029 0.83 TTR (0.36) ALDH1A1TSHRTUBB1KDM4ETDP1
SCHEMBL1080351 0.82 ALDH1A1 (0.50) ALDH1A1TSHRTUBB1KDM4ETDP1
SCHEMBL18400533 0.82 ALDH1A1 (0.50) ALDH1A1TSHRTUBB1KDM4ETDP1
SCHEMBL810222 0.82 TTR (0.49) ALDH1A1KDM4ETTRLMNAMAPT
SCHEMBL10226030 0.82 ALDH1A1 (0.50) ALDH1A1TSHRTUBB1KDM4ETDP1
SCHEMBL12445230 0.82 ERN1 (0.57) ALDH1A1TSHRTUBB1KDM4ETDP1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100540529-C Azo monomer and polymkeric substance with third order non-linear optical property UNIV SUZHOU (CN) 2009-09-16 CN claimed
CN-101012182-A Azo monomer and polymer with third order non-linear optical property UNIV SOOCHOW (CN) 2007-08-08 CN claimed
CN-1975552-A Third order non-linear optical material monomer, its polymer and production UNIV SUZHOU (CN) 2007-06-06 CN claimed
CN-102631954-B Chelation ion exchange fiber capable of resisting marine organism stain and preparation method thereof HUAIHAI INST TECHNOLOGY 2014-05-14 CN disclosed
CN-102585646-B Silicone acrylic resin based ocean anti-fouling paint and preparation method thereof HUAIHAI INST TECHNOLOGY 2014-04-02 CN disclosed
CN-102631954-A Chelation ion exchange fiber capable of resisting marine organism stain and preparation method thereof HUAIHAI INST TECHNOLOGY 2012-08-15 CN disclosed
CN-102585646-A Silicone acrylic resin based ocean anti-fouling paint and preparation method thereof HUAIHAI INST TECHNOLOGY 2012-07-18 CN disclosed
CN-1975552-B Third order non-linear optical material monomer, its polymer and production UNIV SUZHOU 2010-05-19 CN disclosed
CN-100540529-C Azo monomer and polymkeric substance with third order non-linear optical property UNIV SUZHOU (CN) 2009-09-16 CN disclosed
CN-101012182-A Azo monomer and polymer with third order non-linear optical property UNIV SOOCHOW (CN) 2007-08-08 CN disclosed
CN-1975552-A Third order non-linear optical material monomer, its polymer and production UNIV SUZHOU (CN) 2007-06-06 CN disclosed
WO-1995008549-A1 3-(5-TETRAZOLYL-BENZYL)AMINO-PIPERIDINE DERIVATIVES AND ANTAGONISTS OF TACHYKININS GLAXO GROUP LIMITED (GB) 1995-03-30 WO disclosed
EP-0283951-B1 POLYSACCHARIDE DERIVATIVES CONTAINING ALDEHYDE GROUPS, THEIR PREPARATION FROM THE CORRESPONDING ACETALS AND USE IN PAPER National Starch and Chemical Investment Holding Corporation (US) 1993-09-08 EP disclosed
US-5011918-A Siloxane Derivatives Are Useful In Glass Fiber Sizing Compositions NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1991-04-30 US disclosed
US-4929670-A GLASS SIZING COMPOSITIONS NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1990-05-29 US disclosed
US-4839449-A SIZING COMPOSITION FOR GLASS NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1989-06-13 US disclosed
EP-0314063-A2 Polysaccharides containing aromatic aldehydes and their derivatization via amine-aldehyde interactions National Starch and Chemical Corporation (US) 1989-05-03 EP disclosed
US-4788280-A Polysaccharide derivatives containing aldehyde groups on an aromatic ring, their preparation from the corresponding acetals and use in paper NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1988-11-29 US disclosed
EP-0283951-A1 Polysaccharide derivatives containing aldehyde groups, their preparation from the corresponding acetals and use in paper National Starch and Chemical Investment Holding Corporation (US) 1988-09-28 EP disclosed
US-4328226-A Quaternary benzylmorpholine salts having formyl or nitrile substituents in a ring and fungicidal compositions INSTYTUT PRZEMYSLU ORGANICZNEGO & POLITECHNIKA WROCLAWSKA (PL) 1982-05-04 US disclosed