SCHEMBL9131

SCHEMBL9131

Cc1ccccc1B(O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
ACHE P22303 2/20 0.50
ENPP2 Q13822 2/20 0.48
ALDH1A1 P00352 3/20 0.41
CA7 P43166 2/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
ORAI1 Q96D31 1/20 0.41
ORAI2 Q96SN7 1/20 0.41
ORAI3 Q9BRQ5 1/20 0.41
LIPG Q9Y5X9 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
LIPE Q05469 1/20 0.39
MAPT P10636 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL28083714 1.00 TSHR (0.50) TSHRACHEENPP2ALDH1A1CA7
SCHEMBL29392408 1.00 TSHR (0.50) TSHRACHEENPP2ALDH1A1CA7
Water SCHEMBL28105165 0.97 TSHR (0.47) TSHRACHEENPP2ALDH1A1CA7
Ammonia Solution, Strong SCHEMBL27982010 0.97 TSHR (0.47) TSHRACHEENPP2ALDH1A1CA7
Dimethylamine SCHEMBL4538 0.92 ENPP2 (0.43) TSHRACHEENPP2ALDH1A1CA7
SCHEMBL7032190 0.86 ORAI1 (0.50) TSHRACHEENPP2ALDH1A1CA7
Diethylamine SCHEMBL1133302 0.84 LIPG (0.40) TSHRACHEENPP2ALDH1A1ORAI1
Tolyl Boronic Acid SCHEMBL28299771 0.84 CA2 (0.67) TSHRENPP2CA7CA4CA6
SCHEMBL2323835 0.84 ENPP2 (0.38) TSHRACHEENPP2ORAI1ORAI2
SCHEMBL12270850 0.83 TSHR (0.45) TSHRACHEENPP2ALDH1A1CA7

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 6606 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260092028-A1 ONE-POT SYNTHESIS OF SUBSTITUTED FLOURENES CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2026-04-02 US claimed
US-20250194617-A1 Materials and Methods for Extending Shelf-Life of Foods JP LABORATORIES, INC. 2025-06-19 US claimed
US-20250169514-A1 Materials and Methods for Extending Shelf-Life of Foods JP LABORATORIES, INC. 2025-05-29 US claimed
CN-119552180-A Hydrolysis-resistant and corrosion-resistant integrated organic borate lubricating oil additive, and preparation method and application thereof 青海大学 2025-03-04 CN claimed
CN-119264060-A 6-Morpholine-N, 2-diphenyl pyrimidine-4-carboxamide compound and preparation method and application thereof 浙江科技大学 2025-01-07 CN claimed
EP-4263676-B1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL INT RESEARCH (NL) 2024-10-30 EP claimed
EP-4263677-B1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL INT RESEARCH (NL) 2024-10-30 EP claimed
CN-118755102-A Near-infrared self-healing epoxy resin and preparation method and application thereof 北京化工大学 2024-10-11 CN claimed
CN-118758925-A Colorimetric indicator displacement sensing array and application thereof in white tea rapid identification 集美大学 2024-10-11 CN claimed
CN-118164900-A Multifunctional pyridine compound and preparation method and application thereof 昆明理工大学 2024-06-11 CN claimed
WO-2002048160-A1 STERICALLY HINDERED PHOSPHINE LIGANDS AND USES THEREOF YALE UNIVERSITY (US) 2002-06-20 WO claimed
US-6403801-B1 MIXING IN LIQUID MEDIUM STRONG BASE, ARYL HALIDE OR ARYL PSEUDOHALIDE, ARYLBORONIC ACID, NICKEL, PALLADIUM OR PLATINUM COMPOUND, N-HETEROCYCLIC CARBENE SELECTED FROM IMIDAZOLINE-2-YLIDENE, BIS(IMIDAZOLINE-2-YLIDENE) OR SALTS UNIVERSITY OF NEW ORLEANS RESEARCH & TECHNOLOGY FOUNDATION 2002-06-11 US claimed
WO-2002011883-A1 CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION YALE UNIVERSITY (US) 2002-02-14 WO claimed
WO-2001066248-A2 C-C AND C-N COUPLING CATALYST COMPRISING TRANSITION METAL AND CARBENE UNIVERSITY OF NEW ORLEANS RESEARCH AND TECHNOLOGY FOUNDATION (US) 2001-09-13 WO claimed
EP-1107982-A1 REVERSIBLE BORONATE COMPLEXES OF 1,2-$i(CIS)-DIOL CYCLIC-PEPTIDES Eli Lilly & Company (US) 2001-06-20 EP claimed
WO-2000012540-A1 REVERSIBLE BORONATE COMPLEXES OF 1,2-CIS-DIOL CYCLIC-PEPTIDES ELI LILLY AND COMPANY (US) 2000-03-09 WO claimed
CN-1222161-A Process for preparing certain aza cyclohexapeptides MERCK & CO INC (US) 1999-07-07 CN claimed
WO-1995005081-A1 BIOCIDAL COMPOSITIONS CONTAINING ORGANOBORON COMPOUNDS U.S. BORAX INC. (US) 1995-02-23 WO claimed
US-5254255-A Using solvent soluble extraction enhancing acid E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-10-19 US claimed
US-5254776-A Synthesis of bromobiphenyls MALLINCKRODT SPECIALTY CHEMICALS COMPANY (US) 1993-10-19 US claimed