SCHEMBL77563

SCHEMBL77563

O=C(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.70
CES2 O00748 1/20 0.70
AKR1B1 P15121 1/20 0.70
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
FNTA P49354 1/20 0.56
FNTB P49356 1/20 0.56
L3MBTL1 Q9Y468 3/20 0.55
TDP1 Q9NUW8 1/20 0.55
ALDH1A1 P00352 1/20 0.54
MAPK1 P28482 1/20 0.54
CTBP2 P56545 1/20 0.54
EPHX2 P34913 1/20 0.54
TSHR P16473 2/20 0.52
ABCC4 O15439 1/20 0.52
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
PTGS1 P23219 1/20 0.52

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
SCHEMBL9693670 0.97 CES1 (0.67) CES1CES2AKR1B1MEN1KMT2A
Hydrochloric Acid SCHEMBL27690655 0.97 CES1 (0.67) CES1CES2AKR1B1MEN1KMT2A
Methyl Alcohol SCHEMBL11054071 0.95 CES1 (0.64) CES1CES2AKR1B1MEN1KMT2A
Ethylene Glycol SCHEMBL28363278 0.92 CES1 (0.61) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL6512327 0.92 CES1 (0.61) CES1CES2AKR1B1MEN1KMT2A
Phenol SCHEMBL27573994 0.90 FNTA (0.65) CES1CES2AKR1B1MEN1KMT2A
Alcohol SCHEMBL10996109 0.90 CES1 (0.58) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL8619264 0.89 CES1 (0.64) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL51367 0.89 CES1 (0.64) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL4029483 0.88 FNTA (0.76) CES1CES2AKR1B1FNTAFNTB

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

Appears in 4790 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117899898-B Metal phosphate catalyst and preparation and application thereof NANJING NORMAL UNIVERSITY (CN) 2026-05-26 CN claimed
US-20260107628-A1 SYNTHESIS METHOD FOR HEXAPHENYLBENZENE-BASED ORGANIC SMALL MOLECULES AND APPLICATION IN ELECTROLUMINESCENT DEVICES TIANJIN UNIVERSITY (CN) 2026-04-16 US claimed
US-20260062530-A1 POLYARYLETHERKETONE (PAEK) GELS AND AEROGELS VIRGINIA TECH INTELLECTUAL PROPERTIES INC (US) 2026-03-05 US claimed
US-20250281880-A1 Method of Preparing Reverse Osmosis Membrane with Charged Hydrogel and Polyamide Double Network HARBIN INSTITUTE OF TECHNOLOGY (CN) 2025-09-11 US claimed
CN-119954584-A Synthesis method of hexaphenyl benzene organic micromolecules and application of hexaphenyl benzene organic micromolecules in electroluminescent devices 天津大学 2025-05-09 CN claimed
CN-115417954-B Photo-thermal dual-curing polyurethane polymer, preparation method and composite material thereof 万华化学(北京)有限公司 2025-04-01 CN claimed
CN-119500085-A Preparation method of modified activated carbon for removing formaldehyde 木林森活性炭江苏有限公司 2025-02-25 CN claimed
WO-2025038817-A1 BIOMASS CONVERSION TO BIO-JET OVER HETEROGENEOUS CATALYSTS ExxonMobil Technology and Engineering Company (US) 2025-02-20 WO claimed
US-20250033082-A1 METHOD AND COMPOSITION FOR REDUCING SOLVENT RELEASE FROM, AND REDUCING ODOR OF, AGROCHEMICAL FORMULATIONS ADAMA MAKHTESHIM LTD. (IL) 2025-01-30 US claimed
CN-119039269-A High-refractive-index thioether-type episulfide compound as well as preparation method and application thereof 江苏视科新材料股份有限公司 2024-11-29 CN claimed
US-4698376-A UNDERCOATINGS; IMPROVE ADHESION TO POLYMERS BAYER AKTIENGESELLSCHAFT (DE) 1987-10-06 US claimed
US-4560554-A ODORLESS-MIXTURE OF KETONE NEUTRALIZER AND OXIDIZER SHISEIDO COMPANY LTD. (JP) 1985-12-24 US claimed
US-4533742-A USING RHODIUM CARBONYL CATALYST TEXACO INC. (US) 1985-08-06 US claimed
US-4494825-A Fill port seal with first and second photosensitizers HITACHI, LTD. (JP) 1985-01-22 US claimed
US-4493904-A COORDINATION, POLYMERIZATION CATALYST CONTAINING TITANIUM TRICHORI CONOCO INC. (US) 1985-01-15 US claimed
US-4448657-A USING OIL SOLUBLE PHOTOINITIATORS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1984-05-15 US claimed
EP-0095587-A2 Dental composite and porcelain repair DEN-MAT CORPORATION (US) 1983-12-07 EP claimed
US-4266055-A CHEMICAL INTERMEDIATE TO MERCAPTO PRODUCT NIPPON KASEI CHEMICAL CO., LTD. (JP) 1981-05-05 US claimed
US-4169951-A PROCESS FOR THE PRODUCTION OF SUBSTITUTED PYRIDINE (B) DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1979-10-02 US claimed
US-3936473-A COPPER OR NOBLE METAL SALT, OXYGEN AND ORGANIC ACID CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-02-03 US claimed