SCHEMBL112789

SCHEMBL112789

NP(=O)(OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.63
IDO1 P14902 1/20 0.50
AGXT P21549 1/20 0.48
CETP P11597 3/20 0.47
CA2 P00918 2/20 0.47
CA1 P00915 1/20 0.47
CA9 Q16790 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SRC P12931 1/20 0.44
PDPK1 O15530 1/20 0.43
MTOR P42345 1/20 0.43
PARP10 Q53GL7 1/20 0.43
ALPG P10696 1/20 0.43
PTK2B Q14289 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL10931929 0.86 TSHR (0.63) TSHRIDO1AGXTCETPCA2
SCHEMBL15169575 0.84 TSHR (0.47) TSHRIDO1CETPNPC1RAB9A
SCHEMBL21764816 0.84 CETP (0.55) TSHRCETPL3MBTL1
SCHEMBL31110322 0.83 TSHR (0.54) TSHRCETPNPC1RAB9ASRC
SCHEMBL29903000 0.83 TSHR (0.54) TSHRCETPNPC1RAB9ASRC
SCHEMBL10308513 0.83 TSHR (0.59) TSHRIDO1AGXTCETPCA2
SCHEMBL1460673 0.83 TSHR (0.70) TSHRIDO1AGXTCETPNPC1
SCHEMBL3082859 0.83 TSHR (0.59) TSHRIDO1AGXTCETPCA2
SCHEMBL21764743 0.82 ALDH1A1 (0.53) TSHRCETPNPC1RAB9APARP10
SCHEMBL206609 0.81 TSHR (0.68) TSHRIDO1AGXTCETPCA2

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 3928 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12060334-B2 3-substituted phenazine derivatives as antimicrobial agents UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-08-13 US claimed
EP-3715346-B1 THIAZOLYL-CONTAINING COMPOUNDS FOR TREATING PROLIFERATIVE DISEASES DANA FARBER CANCER INST INC (US) 2024-01-03 EP claimed
EP-3606528-B1 TRICYCLIC COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 (GSK3) INHIBITORS AND USES THEREOF BROAD INST INC (US) 2023-10-18 EP claimed
US-20230313074-A1 WASHING AND CLEANING AGENTS HAVING IMPROVED ENZYME STABILITY HENKEL AG & CO. KGAA (DE) 2023-10-05 US claimed
CN-115368757-B Preparation process of high-strength high-barrier high-thermal-stability modified graphene powder 安徽嘉阳新材料科技有限公司 2023-07-28 CN claimed
CN-115449165-B Environment-friendly flame-retardant polyvinyl chloride/graphene composite decorative film for rail transit 安徽嘉阳新材料科技有限公司 2023-07-28 CN claimed
EP-4200309-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES ATEA Pharmaceuticals, Inc. (US) 2023-06-28 EP claimed
CN-115884977-A Stereoselective preparation of selected purine phosphoramidates 阿堤亚制药公司 2023-03-31 CN claimed
CN-115449165-A Environment-friendly flame-retardant polyvinyl chloride/graphene composite decorative film for rail transit 安徽嘉阳新材料科技有限公司 2022-12-09 CN claimed
CN-115368757-A Preparation process of high-strength high-barrier high-thermal-stability modified graphene powder 安徽嘉阳新材料科技有限公司 2022-11-22 CN claimed
US-10112957-B2 Thiazolyl-containing compounds for treating proliferative diseases DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-10-30 US claimed
US-9856225-B2 Substituted phenazines as antimicrobial agents UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2018-01-02 US claimed
EP-2550285-B1 TRIOXACARCINS AND USES THEREOF HARVARD COLLEGE (US) 2017-07-19 EP claimed
US-20150376201-A1 CORTISTATIN ANALOGUES AND SYNTHESES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-12-31 US claimed
EP-0929636-B1 LIQUID DETERGENTS CONTAINING PROTEOLYTIC ENZYME, PEPTIDE ALDEHYDE AND A SOURCE OF BORIC ACID PROCTER & GAMBLE (US) 2002-12-04 EP claimed
EP-0929639-B1 LIQUID DETERGENTS CONTAINING PROTEOLYTIC ENZYME, PEPTIDE ALDEHYDE AND CALCIUM IONS PROCTER & GAMBLE (US) 2002-11-13 EP claimed
EP-0929639-A1 LIQUID DETERGENTS CONTAINING PROTEOLYTIC ENZYME, PEPTIDE ALDEHYDE AND CALCIUM IONS THE PROCTER & GAMBLE COMPANY (US) 1999-07-21 EP claimed
EP-0929636-A1 LIQUID DETERGENTS CONTAINING PROTEOLYTIC ENZYME, PEPTIDE ALDEHYDE AND A SOURCE OF BORIC ACID THE PROCTER & GAMBLE COMPANY (US) 1999-07-21 EP claimed
WO-1998013459-A1 LIQUID DETERGENTS CONTAINING PROTEOLYTIC ENZYME, PEPTIDE ALDEHYDE AND CALCIUM IONS THE PROCTER & GAMBLE COMPANY (US) 1998-04-02 WO claimed
WO-1998013462-A1 LIQUID DETERGENTS CONTAINING PROTEOLYTIC ENZYME, PEPTIDE ALDEHYDE AND A SOURCE OF BORIC ACID THE PROCTER & GAMBLE COMPANY (US) 1998-04-02 WO claimed