SCHEMBL5828005

SCHEMBL5828005

CC(=C=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.48
CES2 O00748 5/20 0.48
TSHR P16473 3/20 0.43
ALDH1A1 P00352 2/20 0.43
DAO P14920 1/20 0.43
NAPRT Q6XQN6 1/20 0.43
MAPT P10636 4/20 0.40
POLB P06746 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP3A4 P08684 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
CA2 P00918 2/20 0.40
CA4 P22748 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PARP1 P09874 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
CA12 O43570 1/20 0.40

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
SCHEMBL13057536 0.83 CES2 (0.33) CES1CES2
SCHEMBL2275985 0.80 TSHR (0.57) CES1CES2TSHRALDH1A1DAO
SCHEMBL23879907 0.77 ALDH1A1 (0.50) CES1CES2ALDH1A1MAPTTDP1
SCHEMBL28126867 0.76 CES2 (0.44) CES1CES2TSHRALDH1A1DAO
SCHEMBL701017 0.76 CES2 (0.44) CES1CES2TSHRALDH1A1DAO
SCHEMBL3846147 0.76 CES2 (0.44) CES1CES2TSHRALDH1A1DAO
SCHEMBL9194201 0.76 CES2 (0.44) CES1CES2TSHRALDH1A1DAO
SCHEMBL14391249 0.75 PARP1 (0.53) POLBTDP1PARP1SMN1; SMN2MEN1
SCHEMBL15656328 0.74 CES2 (0.42) CES1CES2TSHRALDH1A1DAO
SCHEMBL2458795 0.74 CES2 (0.42) CES1CES2TSHRALDH1A1DAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119775681-A Flame-retardant impact-resistant polystyrene material for packaging and preparation method thereof 河北北田工程塑料有限公司 2025-04-08 CN claimed
CN-115073399-B Cinchona alkaloid catalyst and method for preparing chiral beta-butyrolactone compound from cinchona alkaloid catalyst 万华化学集团股份有限公司 2024-02-02 CN claimed
CN-111285977-B Polymer containing carboxylic acid group, preparation method and application thereof 万华化学集团股份有限公司 2023-03-24 CN claimed
CN-115160352-A Bifunctional catalyst derived from hydrogenated cinchona alkaloid and preparation and application thereof 万华化学集团股份有限公司 2022-10-11 CN claimed
CN-115073399-A Cinchona alkaloid catalyst and method for preparing chiral beta-butyrolactone compound by using same 万华化学集团股份有限公司 2022-09-20 CN claimed
CN-111867379-B Pest repellent and pest repellent product 大日本除虫菊株式会社 2021-12-24 CN claimed
CN-119775681-A Flame-retardant impact-resistant polystyrene material for packaging and preparation method thereof 河北北田工程塑料有限公司 2025-04-08 CN disclosed
CN-115073399-B Cinchona alkaloid catalyst and method for preparing chiral beta-butyrolactone compound from cinchona alkaloid catalyst 万华化学集团股份有限公司 2024-02-02 CN disclosed
CN-115160352-B Double-function catalyst derived from hydrogenated cinchona alkaloid and preparation and application thereof 万华化学集团股份有限公司 2023-12-19 CN disclosed
US-20230322996-A1 POLYMER-INTERACTION MOLECULE CONJUGATES AND METHODS OF USE LIFE TECHNOLOGIES AS (NO) 2023-10-12 US disclosed
CN-111378141-B Force-induced response supramolecular polymer 厦门天策材料科技有限公司 2023-04-07 CN disclosed
CN-111040204-B Force-induced response dynamic polymer and application thereof 厦门天策材料科技有限公司 2023-01-24 CN disclosed
CN-115160352-A Bifunctional catalyst derived from hydrogenated cinchona alkaloid and preparation and application thereof 万华化学集团股份有限公司 2022-10-11 CN disclosed
WO-1995014028-A9 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT AND PROPHYLAXIS OF BACTERIAL INFECTIONS 1995-08-10 WO disclosed
WO-1995014028-A2 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT AND PROPHYLAXIS OF BACTERIAL INFECTIONS WASHINGTON UNIVERSITY (US) 1995-05-26 WO disclosed
US-4691020-A Preparation of optically active carboxylic acids BASF AKTIENGESELLSCHAFT (DE) 1987-09-01 US disclosed
EP-0063731-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE CARBOXYLIC ACIDS BASF Aktiengesellschaft (DE) 1984-07-04 EP disclosed
EP-0063731-A1 Process for preparing optically active carboxylic acids BASF Aktiengesellschaft (DE) 1982-11-03 EP disclosed
US-3997500-A ADDITION POLYMER THE DOW CHEMICAL COMPANY (US) 1976-12-14 US disclosed
US-3955027-A FLUOROCARBON POLYMERS, EXTENDERS THE DOW CHEMICAL COMPANY (US) 1976-05-04 US disclosed