SCHEMBL93631

SCHEMBL93631

CO[C](OC)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
SRC P12931 1/20 0.45
CES1 P23141 5/20 0.43
CES2 O00748 3/20 0.43
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 2/20 0.42
ALOX15 P16050 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
F2 P00734 1/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 2/20 0.41
DAO P14920 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
CA4 P22748 1/20 0.41

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
SCHEMBL6000944 0.78 ALDH1A1 (0.57) TSHRKMT2ASMN1; SMN2HPGDMAPT
SCHEMBL1193711 0.77 TSHR (0.56) TSHRSRCCES1CES2KMT2A
SCHEMBL1603720 0.77 TSHR (0.56) TSHRSRCCES1CES2KMT2A
SCHEMBL10873087 0.77 TSHR (0.56) TSHRSRCCES1CES2KMT2A
SCHEMBL4019330 0.77 TSHR (0.56) TSHRSRCCES1CES2KMT2A
SCHEMBL15988227 0.77 TSHR (0.56) TSHRSRCCES1CES2KMT2A
SCHEMBL7443942 0.75 MEN1 (0.41) TSHRKMT2ASMN1; SMN2MEN1LMNA
SCHEMBL8077277 0.74 CA12 (0.58) TSHRKMT2ASMN1; SMN2HPGDALOX15
SCHEMBL817841 0.74 TSHR (0.54) TSHRSRCCES1CES2KMT2A
SCHEMBL25137340 0.72 TSHR (0.52) TSHRSRCCES1CES2KMT2A

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 3456 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024094607-A1 ISOTOPE LABELED AND NON-LABELED GENTAMICIN C CONGENERS ROCHE DIAGNOSTICS GMBH (DE) 2024-05-10 WO claimed
CN-117486966-A Method for synthesizing brassinolide 山东成武泽大泛科化工有限公司 2024-02-02 CN claimed
WO-2024010870-A2 CRYSTALLINE MONOMERS FOR PREPARING ANTISENSE OLIGONUCLEOTIDES AND METHODS OF THEIR PREPARATION AND USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2024-01-11 WO claimed
EP-4272000-A2 LINKER STRUCTURES WITH MINIMAL SCAR FOR ENZYMATIC SYNTHESIS Microsoft Technology Licensing LLC (US) 2023-11-08 EP claimed
EP-3575281-B1 DIAMINE COMPOUND, AND POLYIMIDE COMPOUND AND MOLDED ARTICLE IN WHICH SAID DIAMINE COMPOUND IS USED WINGO TECH CO LTD (JP) 2023-08-23 EP claimed
WO-2023150653-A1 PROCESS FOR SYNTHESIS OF QUINAZOLINE COMPOUNDS GENENTECH, INC. (US) 2023-08-10 WO claimed
US-20230250074-A1 PROCESS FOR SYNTHESIS OF QUINAZOLINE COMPOUNDS GENENTECH, INC. (US) 2023-08-10 US claimed
EP-4196470-A1 SYNTHESIS OF QUINAZOLINE COMPOUNDS Genentech, Inc. (US) 2023-06-21 EP claimed
US-20230151047-A1 LINKER STRUCTURES WITH MINIMAL SCAR FOR ENZYMATIC SYNTHESIS MICROSOFT TECHNOLOGY LICENSING, LLC 2023-05-18 US claimed
CN-110139674-B Method for preparing antibody drug conjugates 豪夫迈·罗氏有限公司 2023-05-16 CN claimed
EP-0146900-A2 Process for producing azetidinones Takeda Chemical Industries, Ltd. (JP) 1985-07-03 EP claimed
US-4520193-A Cephalosporin derivatives RHONE-POULENC INDUSTRIES (FR) 1985-05-28 US claimed
EP-0093010-A2 Alpha-hydroxyethylphosphinates, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-11-02 EP claimed
EP-0053540-A1 Cephalosporin derivatives and their preparation RHONE-POULENC SANTE (FR) 1982-06-09 EP claimed
US-4235906-A MUSCLE RELAXANTS MASSACHUSETTS GENERAL HOSPITAL (US) 1980-11-25 US claimed
US-4232014-A AMIDOALKYLINDANS MARION LABORATORIES, INC. (US) 1980-11-04 US claimed
US-4159267-A Novel silyl ester azetidine-2-sulfenate intermediates and process for preparing desacetoxycephalosporins ELI LILLY AND COMPANY (US) 1979-06-26 US claimed
US-4145538-A 3-Carbamyloxymethyl-cephalosporins ELI LILLY AND COMPANY (US) 1979-03-20 US claimed
US-3993643-A ANTISCHISTOSOMAL STANFORD RESEARCH INSTITUTE (US) 1976-11-23 US claimed
US-3944545-A Process for preparing desacetoxycephalosporins ELI LILLY AND COMPANY (US) 1976-03-16 US claimed