SCHEMBL830126

SCHEMBL830126

O=C(O)c1ccccc1OOCl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.55
ALDH1A1 P00352 9/20 0.55
HSD17B10 Q99714 6/20 0.55
HPGD P15428 6/20 0.55
HMGB1 P09429 2/20 0.55
NAPRT Q6XQN6 2/20 0.55
ESR1 P03372 1/20 0.55
ITGB3 P05106 1/20 0.55
ITGA2B P08514 1/20 0.55
TSHR P16473 1/20 0.55
GGT1 P19440 1/20 0.55
PTGS1 P23219 1/20 0.55
PTGS2 P35354 1/20 0.55
BLM P54132 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
MAPT P10636 2/20 0.53
USP2 O75604 1/20 0.53
PDE3A Q14432 1/20 0.53
ALOX15 P16050 1/20 0.52
HTT P42858 3/20 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
SCHEMBL31157845 1.00 KDM4E (0.55) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL29010714 0.87 KDM4E (0.63) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL372308 0.83 ALDH1A1 (0.59) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL28818676 0.82 TSHR (0.55) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL21753718 0.81 KDM4E (0.57) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL31664325 0.79 KDM4E (0.61) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL5459 0.79 KDM4E (0.61) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL7191217 0.79 ALDH1A1 (0.59) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL28975962 0.79 KDM4E (0.55) KDM4EALDH1A1HSD17B10HPGDHMGB1
SCHEMBL446113 0.78 HTT (0.77) KDM4EALDH1A1HSD17B10HPGDHMGB1

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

Claimed or disclosed in 123 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107868088-A Benzodiazepine * class nitrogen oxides 宜昌人福药业有限责任公司 2018-04-03 CN claimed
CN-107365422-A The hydrophilic modification method and modified resulting materials of poly (glycidyl methacrylate) class or its copolymer 中国科学院过程工程研究所 2017-11-21 CN claimed
CN-106589201-A Hydrophilic modification method of polystyrene material and product thereof 中国科学院过程工程研究所 2017-04-26 CN claimed
CN-102701948-B Refining method for ibuprofen production SHANDONG XINHUA PHARMACEUTICAL 2013-12-11 CN claimed
CN-102701948-A Refining method for ibuprofen production SHANDONG XINHUA PHARMACEUTICAL 2012-10-03 CN claimed
CN-101704801-B Cinepazide oxynitride, and preparation method and applications thereof BEIJING SIHUAN PHARM CO LTD 2011-06-01 CN claimed
CN-101704801-A Cinepazide oxynitride, and preparation method and applications thereof BEIJING SIHUAN PHARMACEUTICAL 2010-05-12 CN claimed
US-4983753-A Precursors and synthesis of di-(methyl)-16,16-(dimethyl)-11-alpha,15-alpha beta-dihydroxy-9-oxo-2,13-trans,trans-prostadienoates FLOYD JR MIDDLETON B (US) 1991-01-08 US claimed
CN-85107830-A The imidazoles that replaces and the preparation method of triazole 1986-07-02 CN claimed
EP-4622959-A1 2-AMINO-N-(4-AMINO-3,4-DIOXO-1-(2-OXOPYRROLIDIN-3-YL)BUTAN-2-YL)BENZAMIDE DERIVATIVES AS PROTEASE INHIBITORS FOR TREATING OR PREVENTING CORONAVIRUS INFECTION Merck Sharp & Dohme LLC (US) 2025-10-01 EP disclosed
EP-3760734-B1 NUCLEIC ACID MODIFICATION AND IDENTIFICATION METHOD IMBA INST MOLEKULARE BIOTECH (AT) 2025-08-20 EP disclosed
WO-2024112621-A1 2-AMINO-N-(4-AMINO-3,4-DIOXO-1-(2-OXOPYRROLIDIN-3-YL)BUTAN-2-YL)BENZAMIDE DERIVATIVES AS PROTEASE INHIBITORS FOR TREATING OR PREVENTING CORONAVIRUS INFECTION MERCK SHARP & DOHME LLC (US) 2024-05-30 WO disclosed
EP-4333899-A1 COMPOUNDS FOR TARGETING DEGRADATION OF BRUTON'S TYROSINE KINASE Biogen MA Inc. (US) 2024-03-13 EP disclosed
US-11859248-B2 Nucleic acid modification and identification method IMBA—INSTITUT FÜR MOLEKULARE BIOTECHNOLOGIE GMBH (AT) 2024-01-02 US disclosed
CN-1069268-A Novel herbicide RHONE POULENC AGRICULTURE (GB) 1993-02-24 CN disclosed
EP-0515546-A1 TRIAZOLE ANGIOTENSIN II ANTAGONISTS INCORPORATING A SUBSTITUTED BENZYL ELEMENT MERCK & CO. INC. (US) 1992-12-02 EP disclosed
CN-1060385-A Weed killer herbicide TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1992-04-22 CN disclosed
EP-0305514-A1 IMPACT MODIFIED POLYESTER COMPOSITIONS WITH IMPROVED HEAT RESISTANCE GENERAL ELECTRIC COMPANY (US) 1989-03-08 EP disclosed
CN-87103317-A 5-acyloxy-13 β-alkyl mibemycin the derivative of control parasites of animals or plants 1988-11-16 CN disclosed
WO-1988007065-A1 IMPACT MODIFIED POLYESTER COMPOSITIONS WITH IMPROVED HEAT RESISTANCE GENERAL ELECTRIC COMPANY (US) 1988-09-22 WO disclosed