SCHEMBL264832

SCHEMBL264832

CCCCCCC[N+](=O)[O-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 1.00
TSHR P16473 3/20 0.45
THRB P10828 1/20 0.44
CES2 O00748 4/20 0.42
CES1 P23141 4/20 0.42
TDP1 Q9NUW8 1/20 0.39
DNM1 Q05193 1/20 0.38
EPHX2 P34913 1/20 0.36
PPARG P37231 5/20 0.35
PPARA Q07869 1/20 0.35
TRPA1 O75762 1/20 0.35
FBP1 P09467 1/20 0.35

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
SCHEMBL31325309 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1
SCHEMBL30906963 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1
SCHEMBL1117292 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1
SCHEMBL491198 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1
SCHEMBL1117388 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1
SCHEMBL1117344 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1
SCHEMBL264639 1.00
SCHEMBL1117329 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1
SCHEMBL1117312 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1
SCHEMBL30906969 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTHRBCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113645850-A Methods of modulating gastrointestinal metabolites 帝斯曼知识产权资产管理有限公司 2021-11-12 CN claimed
EP-3876747-A1 METHODS OF MODULATING GASTROINTESTINAL METABOLITES DSM IP Assets B.V. (NL) 2021-09-15 EP claimed
CN-1974009-A Bifunctional chiral sacchariferous semicarbazide and thiocarbamide catalyst and its prepn process and application in asymmetric reaction UNIV TIANJIN (CN) 2007-06-06 CN claimed
EP-0381235-B1 PYRROLIDINE COMPOUND AND PHARMACEUTICAL USE Eisai Co., Ltd. (JP) 1993-07-28 EP claimed
EP-0381235-A2 Pyrrolidine compound and pharmaceutical use Eisai Co., Ltd. (JP) 1990-08-08 EP claimed
US-4709107-A Process for producing nitrones GENERAL ELECTRIC COMPANY (US) 1987-11-24 US claimed
EP-4727916-A1 MIXED AMIDE ESTER CONTAINING LIPIDS FOR USE IN LIPID NANOPARTICLES Acuitas Therapeutics, Inc. (CA) 2026-04-22 EP disclosed
EP-4638462-A1 2-HYDROXY AND 4-HYDROXY GLYCOLIPIDS AND THEIR DERIVATIVES Glycosurf, Inc. (US) 2025-10-29 EP disclosed
EP-4260070-B1 DIAGNOSIS OF AUTISM SPECTRUM DISORDER STALICLA S A (CH) 2025-09-24 EP disclosed
US-20250212913-A1 METHODS OF MODULATING GASTROINTESTINAL METABOLITES DSM IP ASSETS BV (NL) 2025-07-03 US disclosed
US-20250185695-A1 METHODS OF MODULATING GASTROINTESTINAL METABOLITES DSM IP ASSETS BV (NL) 2025-06-12 US disclosed
US-20250185693-A1 METHODS OF MODULATING GASTROINTESTINAL METABOLITES DSM IP ASSETS BV (NL) 2025-06-12 US disclosed
US-20250185694-A1 METHODS OF MODULATING GASTROINTESTINAL METABOLITES DSM IP ASSETS BV (NL) 2025-06-12 US disclosed
US-5015692-A Rubbers for tires having impact strength SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-14 US disclosed
US-4957976-A IMPROVED PROPERTIES FOR AUTOMOBILE TIRES, MODIFIED WITH PHOSPHORYL CHLORIDE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1990-09-18 US disclosed
EP-0194589-B1 APPARATUS AND METHOD FOR CLEANING AND DRYING SURFACES OF NON-ABSORBENT ARTICLES AlliedSignal Inc. (US) 1989-11-15 EP disclosed
EP-0341496-A2 Modified diene polymer rubbers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-11-15 EP disclosed
EP-0270071-A2 Process for preparing modified diene polymer rubbers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-06-08 EP disclosed
US-4066699-A PROCESS FOR THE HYDROGENATION OF NITRATED PARAFFINS USING A PALLADIUM ON CARBON CATALYST CHARACTERIZED BY A LOW ASH AND A LOW HALIDE CONTENT TEXACO INC. (US) 1978-01-03 US disclosed
US-3965103-A BACTERICIDE, FUNGICIDE SCHERING AKTIENGESELLSCHAFT (DT) 1976-06-22 US disclosed