SCHEMBL1008129

SCHEMBL1008129

CCC(C(=O)O)[N+](=O)[O-]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Hydrochloric Acid SCHEMBL11628885 0.98 ALDH1A1 (0.41)
Nitromethane SCHEMBL28456989 0.95 ALDH1A1 (0.39)
SCHEMBL9851962 0.83 CHRM1 (0.48)
SCHEMBL11627708 0.80
SCHEMBL11508090 0.80
SCHEMBL4155118 0.79 CA2 (0.48)
SCHEMBL530226 0.78
SCHEMBL11507199 0.78 ALDH1A1 (0.41)
SCHEMBL5828243 0.78 GPR84 (0.50)
SCHEMBL9452644 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025244913-A1 ONE-POT SYNTHESIS OF DISUBSTITUTED FUROXANS PURDUE RESEARCH FOUNDATION (US) 2025-11-27 WO claimed
CN-119409702-A Synthesis method of dipyridamole key intermediate 南通森萱药业有限公司 2025-02-11 CN claimed
CN-115677608-B Benzisoxazole-3-carboxamide compound and synthesis and application thereof 复旦大学 2024-06-07 CN claimed
CN-110218211-A A kind of simple and convenient process for preparing of nevirapine 新发药业有限公司 2019-09-10 CN claimed
CN-109180687-A A kind of preparation method of auspicious Kappa step intermediate 山东轩德医药科技有限公司 2019-01-11 CN claimed
EP-2808885-B1 Precursor for planar deprocessing of semiconductor devices using a focused ion beam FEI CO (US) 2018-09-12 EP claimed
CN-107567464-A For the method for the polydiene and polydiene copolymer that produce cold flow properties reduction 株式会社普利司通 2018-01-09 CN claimed
EP-3204429-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW Bridgestone Corporation (JP) 2017-08-16 EP claimed
WO-2016057388-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2016-04-14 WO claimed
EP-1301565-B1 REAGENTS FOR HEAT ACTIVATED POLYMER CROSSLINKING NAT STARCH CHEM INVEST (US) 2009-03-11 EP claimed
CN-119409702-B Synthesis method of dipyridamole key intermediate 南通森萱药业有限公司 2026-02-06 CN disclosed
WO-2025244913-A1 ONE-POT SYNTHESIS OF DISUBSTITUTED FUROXANS PURDUE RESEARCH FOUNDATION (US) 2025-11-27 WO disclosed
US-12459893-B2 Indole-ynone mediated benzoannulation process for the preparation of carbazoles, carbazomycin A, calothrixin B and staurosporinone COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2025-11-04 US disclosed
US-12258349-B2 Anti-viral drug DORING INTERNATIONAL GMBH (CH) 2025-03-25 US disclosed
CN-119409702-A Synthesis method of dipyridamole key intermediate 南通森萱药业有限公司 2025-02-11 CN disclosed
US-4545810-A Herbicidal and plant growth regulant diphenylpyridazinones SDS BIOTECH CORPORATION (US) 1985-10-08 US disclosed
US-4333878-A MAKING 1,4-DIALKYLPYRROLE DIESTERS FROM 2-HYDROCARBOXY-1-NITROALKANE AND ENAMINE OF DIALKYL ACETONE DICARBOXYLATE ETHYL CORPORATION (US) 1982-06-08 US disclosed
WO-1982000402-A1 HERBICIDAL AND PLANT GROWTH REGULANT DIPHENYLPYRIDAZINONES DIAMOND SHAMROCK CORP (US) 1982-02-18 WO disclosed
EP-0046069-A1 Herbicidal and plant growth regulant diphenylpyridazinones DIAMOND SHAMROCK CORPORATION (US) 1982-02-17 EP disclosed
US-4087438-A Thieno[3,4-d]furoxan and process for its preparation SYNTEX (U.S.A.) INC. (US) 1978-05-02 US disclosed