SCHEMBL29429082

SCHEMBL29429082

c1ccc(-c2ccc3ccccc3c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.70
ESR2 Q92731 3/20 0.70
HSD17B1 P14061 1/20 0.64
HSD17B2 P37059 1/20 0.64
ALOX5 P09917 1/20 0.60
CYP11B1 P15538 2/20 0.59
CYP11B2 P19099 2/20 0.59
CYP17A1 P05093 1/20 0.59
CYP19A1 P11511 1/20 0.59
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA9 Q16790 1/20 0.57
GSTP1 P09211 1/20 0.56
CYP1A1 P04798 1/20 0.55
CYP1B1 Q16678 1/20 0.55
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
TP53 P04637 1/20 0.53
CYP1A2 P05177 1/20 0.53

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
SCHEMBL275918 1.00 ESR1 (0.70) ESR1ESR2HSD17B1HSD17B2ALOX5
SCHEMBL26565824 1.00 ESR1 (0.70) ESR1ESR2HSD17B1HSD17B2ALOX5
Biphenyl SCHEMBL4007823 1.00 ESR1 (0.70) ESR1ESR2HSD17B1HSD17B2ALOX5
SCHEMBL26550558 1.00 ESR1 (0.70) ESR1ESR2HSD17B1HSD17B2ALOX5
SCHEMBL4946140 1.00 ESR1 (0.70) ESR1ESR2HSD17B1HSD17B2ALOX5
SCHEMBL29876034 1.00 ESR1 (0.70) ESR1ESR2HSD17B1HSD17B2ALOX5
Methane SCHEMBL29181732 0.97 ESR1 (0.67) ESR1ESR2HSD17B1HSD17B2ALOX5
Selenium SCHEMBL11667707 0.97 ESR1 (0.67) ESR1ESR2HSD17B1HSD17B2ALOX5
SCHEMBL23008065 0.95 ESR1 (0.64) ESR1ESR2HSD17B1HSD17B2ALOX5
SCHEMBL23179575 0.95 HSD17B1 (0.65) ESR1ESR2HSD17B1HSD17B2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4594286-A1 OLIGOMERIC BINAPHTYL COMPOUNDS AND THERMOPLASTIC RESINS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2025-08-06 EP disclosed
CN-119330919-A Preparation method of 8-bromo-6-phenylnaphtho [2,1-b ] benzofuran 中钢天源股份有限公司 2025-01-21 CN disclosed
CN-115650901-B Synthesis method of benzo [ b ] carbazole compound 常州创索新材料科技有限公司 2024-05-31 CN disclosed
WO-2024068860-A1 OLIGOMERIC BINAPHTYL COMPOUNDS AND THERMOPLASTIC RESINS REUTER CHEMISCHE APPARATEBAU E.K. (DE) 2024-04-04 WO disclosed
CN-115650901-A Synthesis method of benzo [ b ] carbazole compound 常州创索新材料科技有限公司 2023-01-31 CN disclosed
CN-114057623-A N-naphthyl indole derivative and synthetic method thereof 湖南第一师范学院 2022-02-18 CN disclosed