SCHEMBL42242

SCHEMBL42242

[CH2]c1cccc(OC)c1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.50
CA12 O43570 3/20 0.48
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA14 Q9ULX7 3/20 0.48
CA7 P43166 2/20 0.48
CA9 Q16790 2/20 0.48
CA4 P22748 1/20 0.48
NFE2L2 Q16236 5/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL151213 0.82 CA1 (0.61) SMN1; SMN2CA12CA1CA2CA14
SCHEMBL27753904 0.82 CA1 (0.61) SMN1; SMN2CA12CA1CA2CA14
SCHEMBL25434306 0.82 CA1 (0.61) SMN1; SMN2CA12CA1CA2CA14
SCHEMBL16953346 0.81 NPSR1 (0.41) SMN1; SMN2CA12CA1CA2CA14
SCHEMBL10981497 0.81 ALDH1A1 (0.42) SMN1; SMN2KDM4EALDH1A1LMNAMAPT
SCHEMBL10980213 0.81 SMN1; SMN2 (0.52) SMN1; SMN2CA12CA1CA2CA14
SCHEMBL5540145 0.81 CA1 (0.44) SMN1; SMN2CA12CA1CA2CA14
SCHEMBL5534722 0.80 CA1 (0.48) SMN1; SMN2CA12CA1CA2CA14
Formaldehyde SCHEMBL28092618 0.80 SMN1; SMN2 (0.54) SMN1; SMN2CA12CA1CA2CA14
SCHEMBL16960162 0.80 HPGD (0.34) SMN1; SMN2CA12CA1CA2CA14

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 4244 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
EP-4178959-A1 NITROGEN HETEROCYCLIC CYTOKININ DERIVATIVES, COMPOSITIONS CONTAINING THESE DERIVATIVES AND USE THEREOF Univerzita Palackého v Olomouci (CZ) 2023-05-17 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-4206213-A IMPROVING PERIPHERAL AND CEREBRAL CIRCULATION DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1980-06-03 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