SCHEMBL7762166

SCHEMBL7762166

C(=CCCc1ccccc1)CCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 11/20 0.57
MAOB P27338 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
ALOX12 P18054 1/20 0.52
CASP1 P29466 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TDP1 Q9NUW8 2/20 0.50
CYP2A6 P11509 1/20 0.50
HTR2A P28223 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.50

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
SCHEMBL9715286 1.00 GPR52 (0.57) GPR52MAOBALDH1A1HPGDALOX15
SCHEMBL7762164 1.00 GPR52 (0.57) GPR52MAOBALDH1A1HPGDALOX15
SCHEMBL433496 0.90 MAOB (0.71) GPR52MAOBALDH1A1HPGDALOX15
SCHEMBL18595441 0.90 MAOB (0.71) GPR52MAOBALDH1A1HPGDALOX15
SCHEMBL28679572 0.90 MAOB (0.71) GPR52MAOBALDH1A1HPGDALOX15
SCHEMBL19031848 0.88 GPR52 (0.48) GPR52MAOBALDH1A1HPGDALOX15
SCHEMBL8553314 0.88 HTR2A (0.58) GPR52MAOBALDH1A1HPGDALOX15
SCHEMBL19031847 0.88 GPR52 (0.48) GPR52MAOBALDH1A1HPGDALOX15
SCHEMBL95418 0.88 GPR52 (0.53) GPR52ALDH1A1HPGDALOX15ALOX12
SCHEMBL4831472 0.88 GPR52 (0.48) GPR52MAOBALDH1A1HPGDALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113880871-B Preparation method of saturated monoboron compound 中国科学院兰州化学物理研究所 2022-08-23 CN disclosed
CN-113880871-A Preparation method of saturated monoboron compound 中国科学院兰州化学物理研究所 2022-01-04 CN disclosed
WO-2001070217-A1 DNA-CLEAVING ANTITUMOR AGENTS RESEARCH DEVELOPMENT FOUNDATION (US) 2001-09-27 WO disclosed
US-5126490-A Rhodium carbonyl catalyst PRINCETON UNIVERSITY (US) 1992-06-30 US disclosed
EP-0488069-A2 A process for the catalytic oxidation of olefins to carbonyl compounds Princeton University (US) 1992-06-03 EP disclosed
EP-0336216-B1 PROCESS FOR THE PREPARATION OF MONOCARBOXYLIC ACID ANHYDRIDES HOECHST AKTIENGESELLSCHAFT (DE) 1991-12-27 EP disclosed
EP-0336215-B1 SUPPORTED CATALYST FOR THE PREPARATION OF ANHYDRIDES OF MONOCARBOXYLIC ACIDS HOECHST AKTIENGESELLSCHAFT (DE) 1991-05-15 EP disclosed
US-4959498-A Process for the preparation of monocarboxylic anhydrides HOECHST AKTIENGESELLSCHAFT (DE) 1990-09-25 US disclosed
US-4876392-A Process for preparation of keystones by oxidation of secondary alcohols using a trimetallic catalyst comprising molybdenum, rhenium and a group VIII noble metal EXXON RESEARCH & ENGINEERING COMPANY (US) 1989-10-24 US disclosed
EP-0336215-A1 Supported catalyst for the preparation of anhydrides of monocarboxylic acids HOECHST AKTIENGESELLSCHAFT (DE) 1989-10-11 EP disclosed
EP-0336216-A1 Process for the preparation of monocarboxylic acid anhydrides HOECHST AKTIENGESELLSCHAFT (DE) 1989-10-11 EP disclosed
EP-0105663-B1 CATALYSTS AND PROCESS FOR OXIDATION OF OLEFINS TO KETONES EXXON RESEARCH AND ENGINEERING COMPANY (US) 1988-06-22 EP disclosed
US-4737482-A RHENIUM, GROUPS 6B AND SB NOBLE METAL SULFIDES ON SUPPORT EXXON RESEARCH & ENGINEERING CO. (US) 1988-04-12 US disclosed
US-4649223-A RHENIUM SULFIDE OXIDATION CATALYST EXXON RESEARCH & ENGINEERING CO. (US) 1987-03-10 US disclosed
US-4560803-A HIGH SELECTIVITY, BY-PRODUCT INHIBITION; RHENIUM GROUP VIB AND GROUP VIII OXIDES AND SULFIDES EXXON RESEARCH & ENGINEERING CO. (US) 1985-12-24 US disclosed
US-4560805-A BY-PRODUCT INHIBITION; RHENIUM SULFIDE PLUS GROUP 8 SULFIDES EXXON RESEARCH & ENGINEERING CO. (US) 1985-12-24 US disclosed
US-4560804-A OXIDATION OF ALKENES USING RARE EARTH SULFIDE CATALYST EXXON RESEARCH & ENGINEERING CO. (US) 1985-12-24 US disclosed
US-4528401-A Catalytic process for the manufacture of ketones EXXON RESEARCH & ENGINEERING CO. (US) 1985-07-09 US disclosed
EP-0105663-A2 Catalysts and process for oxidation of olefins to ketones EXXON RESEARCH AND ENGINEERING COMPANY (US) 1984-04-18 EP disclosed