SCHEMBL111422

SCHEMBL111422

CC(=O)OCCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.64
HCAR2 Q8TDS4 1/20 0.58
TDP1 Q9NUW8 2/20 0.57
ESR1 P03372 1/20 0.56
ESR2 Q92731 1/20 0.56
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
AKR1B10 O60218 2/20 0.54
AKR1B1 P15121 2/20 0.54
TP53 P04637 1/20 0.54
GLA P06280 1/20 0.54
CYP3A4 P08684 1/20 0.54
HPGD P15428 1/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HIF1A Q16665 1/20 0.54
HSD17B10 Q99714 1/20 0.54
LMNA P02545 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
SCHEMBL4351183 1.00 ALDH1A1 (0.64) ALDH1A1HCAR2TDP1ESR1ESR2
Benzene SCHEMBL19304565 1.00 ALDH1A1 (0.64) ALDH1A1HCAR2TDP1ESR1ESR2
Acetic Acid SCHEMBL28067643 0.98 ALDH1A1 (0.62) ALDH1A1HCAR2TDP1ESR1ESR2
Hydrochloric Acid SCHEMBL27545520 0.98 ALDH1A1 (0.62) ALDH1A1HCAR2TDP1ESR1ESR2
SCHEMBL27897041 0.98 ALDH1A1 (0.62) ALDH1A1HCAR2TDP1ESR1ESR2
Acetic Acid SCHEMBL19951529 0.98 ALDH1A1 (0.62) ALDH1A1HCAR2TDP1ESR1ESR2
SCHEMBL28201295 0.98 ALDH1A1 (0.62) ALDH1A1HCAR2TDP1ESR1ESR2
Ethyne SCHEMBL27579020 0.96 ALDH1A1 (0.60) ALDH1A1HCAR2TDP1ESR1ESR2
Alcohol SCHEMBL4648875 0.94 ALDH1A1 (0.58) ALDH1A1HCAR2TDP1ESR1ESR2
Trimethylammonium SCHEMBL9482623 0.94 ALDH1A1 (0.58) ALDH1A1HCAR2TDP1ESR1ESR2

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 14509 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122095072-A Fruit-based or other type of alcoholic beverage production 2026-05-26 CN claimed
CN-122081006-A Fenugreek tincture aroma fitting object based on key aroma components and aroma synergy and application thereof 2026-05-26 CN claimed
CN-122060605-A Pichia pastoris FL2 strain and application thereof 昆明理工大学 2026-05-19 CN claimed
CN-122055435-A Alcohol beverage with high content of fruit-flavor volatile compounds and low volatile acidity and preparation method thereof 拜恩洛基2.0有限公司 2026-05-15 CN claimed
EP-4514146-B1 A COMBINATION FOR USE IN THE PREPARATION OF A DRINKABLE FOAMING OR FOAMABLE LIQUID, A DEVICE AND A METHOD FOR PREPARING AND DISPENSING A DRINKABLE FOAMING OR FOAMABLE LIQUID BAR ON B V (BE) 2026-05-13 EP claimed
CN-122004513-A Fragrant and sweet flavor substance, preparation method thereof and aerosol matrix 东莞市吉纯生物技术有限公司 2026-05-12 CN claimed
EP-4734763-A1 COMPOSITIONS, METHODS AND DEVICES FOR CONTROL AND MONITORING INSECTS Agriculture Victoria Services Pty Ltd (AU) 2026-05-06 EP claimed
US-20260114446-A1 Compositions, Methods and Devices for Control and Monitoring Insects AGRICULTURE VICTORIA SERVICES PTY LTD (AU) 2026-04-30 US claimed
EP-4426105-B1 COCOA PLANT CELL CULTURE PROCESSING METHODS AND PRODUCTS OBTAINED BY THE SAME ZHAW ZUERCHER HOCHSCHULE FUER ANGEWANDTE WSS (CH) 2026-04-29 EP claimed
US-20260096574-A1 CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS VOYAGE FOODS INC (US) 2026-04-09 US claimed
EP-0010455-A1 Cracking process for preparing styrene CHEM SYSTEMS, Inc. (US) 1980-04-30 EP claimed
US-4179526-A 2-((METHYLTHIO)METHYL)-3-PHENYL-2-PROPENAL INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1979-12-18 US claimed
EP-0004732-A1 Preparation of 2-phenylethanol and 2-phenylethyl acetate CHEM SYSTEMS, Inc. (US) 1979-10-17 EP claimed
US-4156029-A Alpha-substituted alkylidene methionals and uses thereof in foodstuffs and flavors for foodstuffs INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1979-05-22 US claimed
US-4110436-A ANIMAL FEEDS, BACTERICIDE, ANTICOCCIDIAL ELI LILLY AND COMPANY (US) 1978-08-29 US claimed
US-4110435-A BACTERICIDE, ANTICOCCIDIAL ELI LILLY AND COMPANY (US) 1978-08-29 US claimed
US-4076924-A CATALYST COMPRISING A TITANIUM COMPONENT AND A GROUP I TO III ORGANO-METAL COMPOUND MITSUI PETROCHEMICAL INDUSTRIES LTD. (JA) 1978-02-28 US claimed
US-4064279-A Alpha-substituted alkylidene methionals and uses thereof in foodstuffs and flavors for foodstuffs INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-12-20 US claimed
US-4038384-A AEROBIC FERMENTATION OF STREPTOMYCES; USED IN RUMINANT FEEDS ELI LILLY AND COMPANY (US) 1977-07-26 US claimed
US-4035481-A ANTIPROTOZOA AGENTS, ANTIBACTERIAL, ANTIFUNGAL, ANTIVIRAL ELI LILLY AND COMPANY (US) 1977-07-12 US claimed