SCHEMBL972914

SCHEMBL972914

O=C(c1ccccc1)C(O)(Br)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.57
SRC P12931 1/20 0.52
CES2 O00748 4/20 0.44
TSHR P16473 3/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 2/20 0.43
KMT2A Q03164 1/20 0.43
CYP2C19 P33261 2/20 0.42
KCNN4 O15554 1/20 0.42
HIF1A Q16665 1/20 0.42
CYP1A2 P05177 1/20 0.41
PTPN1 P18031 1/20 0.41
GSK3B P49841 1/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
PARP1 P09874 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 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
SCHEMBL1666976 0.81 CES1 (0.61) CES1SRCCES2TSHRDAO
SCHEMBL7595936 0.80 CES1 (0.55) CES1SRCCES2TSHRDAO
SCHEMBL58021 0.80 CES1 (0.55) CES1SRCCES2TSHRDAO
SCHEMBL6248474 0.79 CES1 (0.54) CES1SRCCES2TSHRDAO
SCHEMBL242506 0.79 CES1 (0.54) CES1SRCCES2TSHRDAO
SCHEMBL562162 0.79 CES1 (0.54) CES1SRCCES2TSHRDAO
SCHEMBL1079930 0.79 CES1 (0.54) CES1SRCCES2TSHRDAO
SCHEMBL252920 0.79 CES1 (0.54) CES1SRCCES2TSHRDAO
SCHEMBL31323288 0.78 CES1 (0.58) CES1SRCCES2TSHRDAO
SCHEMBL31323287 0.78 CES1 (0.58) CES1SRCCES2TSHRDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3041627-A1 METAL SINTERING FILM COMPOSITIONS Henkel IP & Holding GmbH (DE) 2016-07-13 EP claimed
CN-1678325-A Sapogenin derivatives, their synthesis and use and method based upon the use PHYTOTECH LTD (GB) 2005-10-05 CN claimed
EP-0947521-B1 Removal of dissolved silicates from alcohol-silicon direct synthesis solvents CROMPTON CORP (US) 2003-03-19 EP claimed
EP-0788314-B1 NONDIGESTIBLE FAT COMPOSITIONS CONTAINING DIVERSELY ESTERIFIED POLYOL POLYESTERS FOR PASSIVE OIL LOSS CONTROL PROCTER & GAMBLE (US) 2001-09-12 EP claimed
US-6090965-A Removal of dissolved silicates from alcohol-silicon direct synthesis solvents OSI SPECIALTIES, INC. (US) 2000-07-18 US claimed
EP-0947521-A2 Removal of dissolved silicates from alcohol-silicon direct synthesis solvents WITCO CORPORATION (US) 1999-10-06 EP claimed
EP-0788314-A1 NONDIGESTIBLE FAT COMPOSITIONS CONTAINING DIVERSELY ESTERIFIED POLYOL POLYESTERS FOR PASSIVE OIL LOSS CONTROL THE PROCTER & GAMBLE COMPANY (US) 1997-08-13 EP claimed
US-5480667-A CONTAING NONDIGESTIBLE SOLID POLYOL ESTERS OF SPECIFIED CARBON CHAIN LENGTH FATTY ACID DISPERSED IN LIQUID NONDIGESTIBLE OIL; POTATO CHIPS CORRIGAN PATRICK J (US) 1996-01-02 US claimed
US-5350790-A Aromatic carboxylic acid MITSUBISHI KASEI CORPORATION (JP) 1994-09-27 US claimed
WO-1994009639-A1 NONDIGESTIBLE FAT COMPOSITIONS CONTAINING DIVERSELY ESTERIFIED POLYOL POLYESTERS FOR PASSIVE OIL LOSS CONTROL THE PROCTER & GAMBLE COMPANY (US) 1994-05-11 WO claimed
US-4150206-A SYNERGISTIC CATALYSTS S.A. PRB (BE) 1979-04-17 US claimed
CN-110776583-A Method for synthesizing active bagasse xylan p-bromobenzoic acid/cinnamic acid diester 桂林理工大学 2020-02-11 CN disclosed
CN-110776583-A Method for synthesizing active bagasse xylan p-bromobenzoic acid/cinnamic acid diester 桂林理工大学 2020-02-11 CN disclosed
CN-108593633-A A kind of Test paper for quickly detecting saliva uric acid 中山大学 2018-09-28 CN disclosed
EP-3041627-A1 METAL SINTERING FILM COMPOSITIONS Henkel IP & Holding GmbH (DE) 2016-07-13 EP disclosed
US-4328111-A CORROSION INHIBITION STANDARD OIL COMPANY (INDIANA) (US) 1982-05-04 US disclosed
US-4150206-A SYNERGISTIC CATALYSTS S.A. PRB (BE) 1979-04-17 US disclosed
US-4107210-A Synthesis of alpha-diketones THE DOW CHEMICAL COMPANY (US) 1978-08-15 US disclosed
US-4032550-A IMMOBILIZED SUPPORTED TRANSITION METAL CATALYST EMERY INDUSTRIES, INC. (US) 1977-06-28 US disclosed
US-3945991-A Heterocyclic azo compounds containing a quaternated hydrazide group CIBA-GEIGY AG (CH) 1976-03-23 US disclosed