SCHEMBL5023

SCHEMBL5023

O=C(O)c1cccc(Br)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.65
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA6 P23280 1/20 0.58
CA9 Q16790 1/20 0.58
MRGPRX4 Q96LA9 1/20 0.57
ALDH1A1 P00352 1/20 0.57
TP53 P04637 1/20 0.57
MTOR P42345 1/20 0.54
HPGD P15428 3/20 0.54
C1S P09871 1/20 0.54
KMO O15229 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
HSD17B10 Q99714 1/20 0.54
TSHR P16473 2/20 0.52
DAO P14920 1/20 0.52
NAPRT Q6XQN6 1/20 0.52
UNG P13051 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
SCHEMBL29537403 1.00 PARP1 (0.65) PARP1CA12CA1CA2CA6
Hydrochloric Acid SCHEMBL698593 0.98 PARP1 (0.63) PARP1CA12CA1CA2CA6
SCHEMBL11539652 0.98 PARP1 (0.63) PARP1CA12CA1CA2CA6
Ethane SCHEMBL17336854 0.96 PARP1 (0.61) PARP1CA12CA1CA2CA6
1,2-Dichloroethane SCHEMBL27913129 0.90 PARP1 (0.55) PARP1CA12CA1CA2CA6
Boric Acid SCHEMBL29232610 0.90 PARP1 (0.55) PARP1CA12CA1CA2CA6
SCHEMBL10344732 0.90 PARP1 (0.55) PARP1CA12CA1CA2CA6
Isophthalic Acid SCHEMBL28667980 0.88 CA12 (0.56) PARP1CA12CA1CA2CA6
Pyridine SCHEMBL28674978 0.88 PARP1 (0.53) PARP1CA12CA1CA2CA6
SCHEMBL30014390 0.87 KMO (0.68) PARP1CA12CA1CA2CA6

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 3050 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661890-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS Purdue Research Foundation (US) 2025-12-17 EP claimed
US-12497636-B2 Recombinant Saccharomyces cerevisiae cells for cannabinoid production NATIONAL UNIVERSITY OF SINGAPORE (SG) 2025-12-16 US claimed
CN-120136764-A Pleuromutilin derivative capable of inhibiting bacterial hydrogen sulfide biosynthesis and preparation method and application thereof 陕西科技大学 2025-06-13 CN claimed
CN-120082122-A Antistatic antibacterial functional three-dimensional bag and preparation method thereof 合肥红五月塑料制品有限公司 2025-06-03 CN claimed
EP-4559009-A2 PARTICLES Life Technologies AS (NO) 2025-05-28 EP claimed
CN-119930651-A Thiazolopiperidine-containing derivative, and preparation method and application thereof 南开大学 2025-05-06 CN claimed
CN-119930415-A Preparation method of ketoprofen 山东鲁宁药业有限公司 2025-05-06 CN claimed
CN-119698673-A Particles 生命技术股份公司 2025-03-25 CN claimed
CN-119528908-A Antitumor compound, preparation method, pharmaceutical composition containing compound and application of compound 承德医学院 2025-02-28 CN claimed
CN-119504479-A Capsaicin ester derivative, preparation method and application thereof 西北农林科技大学 2025-02-25 CN claimed
EP-1082607-A1 SURFACE REGENERATION OF BIOSENSORS Biacore AB (SE) 2001-03-14 EP claimed
WO-2000031163-A2 POLY(ARYLENE ETHER) HOMOPOLYMER COMPOSITIONS AND METHODS OF MANUFACTURE THEREOF ALLIEDSIGNAL INC. (US) 2000-06-02 WO claimed
WO-1999063333-A1 SURFACE REGENERATION OF BIOSENSORS BIACORE AB (SE) 1999-12-09 WO claimed
WO-1997027152-A1 SUGAR AND/OR ACID ADDITION TO ANIONIC POLYSACCHARIDE-CONTAINING CEMENTITIOUS FORMULATIONS THE NUTRASWEET COMPANY (US) 1997-07-31 WO claimed
US-5141557-A Mixture of benzoic acid salt, anionic surfactant, and novolak phenolic resin BROTHER KOGYO KABUSHIKI KAISHA (JP) 1992-08-25 US claimed
EP-0271145-B1 PROCESS FOR THE CARBONYLATION OF CONJUGATED DIENES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1991-08-21 EP claimed
US-4982005-A BORON TRIFLUORIDE CATALYST BASF AKTIENGESELLSCHAFT (DE) 1991-01-01 US claimed
EP-0271145-A2 Process for the carbonylation of conjugated dienes SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-06-15 EP claimed
CN-85109332-A The method for preparing benzoic acid derivative 1986-07-02 CN claimed
US-4152160-A PHOTOTHERMOGRAPHY, SILVER BEHENATE FUJI PHOTO FILM CO., LTD. (JP) 1979-05-01 US claimed