SCHEMBL435297

SCHEMBL435297

O=C(c1ccccc1)c1cccc(CBr)c1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.63
ATM Q13315 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
ALDH1A1 P00352 2/20 0.54
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
PBRM1 Q86U86 1/20 0.53
CYP19A1 P11511 1/20 0.51
SRD5A2 P31213 2/20 0.50
TRPA1 O75762 1/20 0.48
TSHR P16473 1/20 0.48
FOLH1 Q04609 1/20 0.47
PTPN1 P18031 1/20 0.46
CNR2 P34972 1/20 0.46
ACHE P22303 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL29728644 1.00 L3MBTL1 (0.63) L3MBTL1ATMTDP1ALDH1A1CES2
SCHEMBL29572523 0.94 ATM (0.52) L3MBTL1ATMTDP1ALDH1A1CES2
SCHEMBL185962 0.94 ATM (0.52) L3MBTL1ATMTDP1ALDH1A1CES2
SCHEMBL20836220 0.91 CES2 (0.56) L3MBTL1ATMTDP1CES2CES1
Benzophenone SCHEMBL27978215 0.88 CES2 (0.67) L3MBTL1ATMTDP1ALDH1A1CES2
SCHEMBL7015547 0.86 SRD5A2 (0.47) L3MBTL1ATMTDP1CES2CES1
SCHEMBL11493619 0.86 MEP1B (0.46) L3MBTL1ATMTDP1ALDH1A1CES2
SCHEMBL11301145 0.85 TDP1 (0.59) L3MBTL1ATMTDP1ALDH1A1PBRM1
SCHEMBL29964040 0.84 FOLH1 (0.66) CES2CES1FOLH1
SCHEMBL40393 0.84 FOLH1 (0.66) CES2CES1FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119080821-A Surface modified compound and preparation method thereof 广州博鹭腾生物科技有限公司 2024-12-06 CN claimed
JP-55154934-A None JP disclosed
JP-9169710-A None JP disclosed
US-20250011622-A1 BLOCK COPOLYMER, UNDERCOAT AGENT, RESIN COMPOSITION FOR FORMING PHASE-SEPARATED STRUCTURE, AND METHOD FOR PRODUCING STRUCTURE BODY INCLUDING PHASE-SEPARATED STRUCTURE TOKYO OHKA KOGYO CO LTD (JP) 2025-01-09 US disclosed
US-20250011616-A1 METHOD FOR PRODUCING STRUCTURE BODY INCLUDING PHASE-SEPARATED STRUCTURE, AND COMPOSITION TOKYO OHKA KOGYO CO LTD (JP) 2025-01-09 US disclosed
CN-119080821-A Surface modified compound and preparation method thereof 广州博鹭腾生物科技有限公司 2024-12-06 CN disclosed
US-20240191003-A1 COMPOSITION AND PHOTOSENSITIVE COMPOSITION TOKYO OHKA KOGYO CO., LTD. (JP) 2024-06-13 US disclosed
CN-116444398-B Preparation method of ketoprofen intermediate formula III 浙江瑞博制药有限公司 2024-06-07 CN disclosed
CN-117908327-A Composition and photosensitive composition 东京应化工业株式会社 2024-04-19 CN disclosed
CN-116761831-A Adjustable high chi diblock copolymers composed of alternating copolymer segments for directed self-assembly and use thereof 默克专利股份有限公司 2023-09-15 CN disclosed
US-4267359-A Novel carboxylic acid esters ZOECON CORPORATION (US) 1981-05-12 US disclosed
EP-0025262-A2 Alpha-thio-alpha-aryl-substituted alkanonitriles, process for their preparation, process for preparing alpha-aryl-substituted alkanonitriles and the corresponding carboxylic acids therefrom and process for preparing intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1981-03-18 EP disclosed
US-4243819-A Substituted amino acids ZOECON CORPORATION (US) 1981-01-06 US disclosed
JP-S55154934-A PREPARATION OF 3-BENZOYLBENZALDEHYDE NISSAN CHEM IND LTD 1980-12-02 JP disclosed
US-4216232-A Pharmaceutical compositions BEECHAM GROUP LIMITED (GB) 1980-08-05 US disclosed
US-4204071-A 4-Aryl-3-butenoic acids and lower alkyl esters ZOECON CORPORATION (US) 1980-05-20 US disclosed
US-4192890-A Novel benzoylphenylacetic acid esters ROUSSEL UCLAF (FR) 1980-03-11 US disclosed
US-4097522-A Synthesis of m-benzoyl-hydratropic acid AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 1978-06-27 US disclosed
US-3995056-A Butyric acid derivatives for treating pain and inflammation ROUSSEL-UCLAF (FR) 1976-11-30 US disclosed
US-3931302-A ANTIINFLAMMATORY, ANALGESIC ROUSSEL-UCLAF (FR) 1976-01-06 US disclosed