SCHEMBL814

SCHEMBL814

O=C(O)C=P(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.59
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA5A P35218 1/20 0.44
ALOX15 P16050 2/20 0.41
TSHR P16473 2/20 0.41
USP2 O75604 1/20 0.41
HDAC3 O15379 1/20 0.39
TNKS O95271 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39

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
Acetic Acid SCHEMBL30721072 0.93 HSP90AA1 (0.53) HSP90AA1CA2CA4CA5AALOX15
Acetaldehyde SCHEMBL31570102 0.91 HSP90AA1 (0.52) HSP90AA1CA2CA4CA5AALOX15
Toluene SCHEMBL8586261 0.89 HSP90AA1 (0.50) HSP90AA1CA2CA4CA5AALOX15
SCHEMBL7522374 0.85 HSP90AA1 (0.59) HSP90AA1CA2CA4CA5AALOX15
SCHEMBL23757989 0.81 HSP90AA1 (0.55) HSP90AA1CA2CA4CA5AALOX15
SCHEMBL5694513 0.81 HSP90AA1 (0.55) HSP90AA1CA2CA4CA5AALOX15
SCHEMBL1508 0.81 HSP90AA1 (0.55) HSP90AA1CA2CA4CA5AALOX15
SCHEMBL11252036 0.81 HSP90AA1 (0.55) HSP90AA1CA2CA4CA5AALOX15
SCHEMBL28824440 0.81 HSP90AA1 (0.55) HSP90AA1CA2CA4CA5AALOX15
SCHEMBL19033787 0.79 HSP90AA1 (0.63) HSP90AA1CA2CA4CA5ATSHR

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 2130 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4396271-A1 COMPOSITION FOR POLYURETHANE FOAM, FOAM PREPARED THEREFROM AND A METHOD THEREOF Momentive Performance Materials Inc. (US) 2024-07-10 EP claimed
WO-2023034354-A1 COMPOSITION FOR POLYURETHANE FOAM, FOAM PREPARED THEREFROM AND A METHOD THEREOF MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2023-03-09 WO claimed
US-20230039886-A1 METHOD FOR SYNTHESIZING URSODEOXYCHOLIC ACID USING BA AS RAW MATERIAL JIANGSU JIAERKE PHARMACEUTICALS GROUP CORP., LTD. (CN) 2023-02-09 US claimed
US-10894121-B2 Small molecule dye for molecular imaging and photothermal therapy THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2021-01-19 US claimed
US-20190192761-A1 SMALL MOLECULE DYE FOR MOLECULAR IMAGING AND PHOTOTHERMAL THERAPY UNITED STATES DEPARTMENT OF ENERGY 2019-06-27 US claimed
US-20150112087-A1 Synthesis of New Anti-Inflammatory Compound XU YONG (US) 2015-04-23 US claimed
WO-1998000423-A1 1-OXO-1,2-DIHYDROISOQUINOLINE-4-PROPANAMIDE DERIVATIVES AND THEIR APPLICATION IN THERAPEUTICS SYNTHELABO (FR) 1998-01-08 WO claimed
EP-0463969-B1 New compounds of 4-aminobutyric acid, process for their preparation and pharmaceutical preparations containing them ADIR (FR) 1995-02-08 EP claimed
US-20260035379-A1 BICYCLIC PYRIDINE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2026-02-05 US disclosed
US-12534475-B2 Bicyclic pyridine derivative Sumitomo Pharma Co., Ltd. (JP) 2026-01-27 US disclosed
US-20250205188-A1 TREATMENT OR PREVENTION OF RESPIRATORY DISEASES CHARACTERISED BY, OR INVOLVING, LUNG FIBROSIS IMPERIAL COLLEGE INNOVATIONS LTD (GB) 2025-06-26 US disclosed
CN-119528956-B BODIPY light-cage chemiluminescent molecule, nano microsphere, and synthesis method and application thereof 中南林业科技大学 2025-05-13 CN disclosed
EP-4523755-A2 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS F. Hoffmann-La Roche AG (CH) 2025-03-19 EP disclosed
CN-119528956-A BODIPY light-cage chemiluminescent molecule, nano microsphere, and synthesis method and application thereof 中南林业科技大学 2025-02-28 CN disclosed
US-4378314-A FOR PENICILLINS AND CEPHALOSPORINS BRISTOL MYERS COMPANY (US) 1983-03-29 US disclosed
US-4272437-A PENICILLINS BRISTOL-MYERS COMPANY (US) 1981-06-09 US disclosed
US-4211783-A Hypolipidemic and antiatherosclerotic novel 4-(aralkyl- and heteroarylalkylamino)phenyl compounds AMERICAN CYANAMID COMPANY (US) 1980-07-08 US disclosed
EP-0003663-A2 Amino-substituted phenyl and heteroaryl compounds, process for their preparation and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1979-08-22 EP disclosed
US-4125713-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-11-14 US disclosed
US-4125712-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-11-14 US disclosed