SCHEMBL33663

SCHEMBL33663

Cc1c(C(=O)O)cccc1[N+](=O)[O-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 1.00
TDP1 Q9NUW8 2/20 0.64
GLA P06280 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
KMT2A Q03164 5/20 0.58
MEN1 O00255 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
CYP2C9 P11712 2/20 0.55
DHODH Q02127 1/20 0.55
LMNA P02545 3/20 0.54
POLB P06746 3/20 0.53
ALDH1A1 P00352 3/20 0.52
CYP2C19 P33261 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
HPGD P15428 1/20 0.51

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
Ammonia Solution, Strong SCHEMBL8032064 0.98 TSHR (0.96) TSHRTDP1GLAL3MBTL1KMT2A
Hydrochloric Acid SCHEMBL5787034 0.98 TSHR (0.96) TSHRTDP1GLAL3MBTL1KMT2A
Hydrochloric Acid SCHEMBL6407719 0.98 TSHR (0.96) TSHRTDP1GLAL3MBTL1KMT2A
Benzoic Acid SCHEMBL6693657 0.92 TSHR (0.84) TSHRTDP1GLAL3MBTL1KMT2A
Phthalic Acid SCHEMBL8740470 0.91 TSHR (0.83) TSHRTDP1GLAL3MBTL1KMT2A
SCHEMBL28224261 0.89 TSHR (0.79) TSHRTDP1GLAL3MBTL1KMT2A
SCHEMBL2932050 0.85 TSHR (0.74) TSHRTDP1GLAL3MBTL1KMT2A
SCHEMBL30041946 0.85 TSHR (0.74) TSHRTDP1GLAL3MBTL1KMT2A
SCHEMBL2885196 0.85 TSHR (0.73) TSHRTDP1GLAL3MBTL1KMT2A
SCHEMBL5727143 0.84 TSHR (0.72) TSHRTDP1GLAL3MBTL1KMT2A

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 1325 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661890-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS Purdue Research Foundation (US) 2025-12-17 EP claimed
CN-119371400-A Lenalidomide amination Process for the preparation of a compound 南京亿华药业有限公司 2025-01-28 CN claimed
CN-119080334-A Comprehensive utilization method of nitric acid containing organic matters 山东友道化学有限公司 2024-12-06 CN claimed
WO-2024167565-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS PURDUE RESEARCH FOUNDATION (US) 2024-08-15 WO claimed
CN-116836061-A Method for separating mixed acid 绍兴贝斯美化工股份有限公司 2023-10-03 CN claimed
CN-116836081-A Ether epoxy toughening agent and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2023-10-03 CN claimed
WO-2022222272-A1 SYNTHESIS PROCESS OF 2-METHYL-3-METHOXYBENZOIC ACID 江苏永安化工有限公司 2022-10-27 WO claimed
CN-113121339-B Co-production process of 3-hydroxy-2-methyl benzoate and 3-methoxy-2-methyl benzoate 江苏永安化工有限公司 2022-10-11 CN claimed
CN-114105773-A Oxidation method of 3-nitro-o-xylene 营口昌成新材料科技有限公司 2022-03-01 CN claimed
CN-111362807-B Preparation method of 3-nitro-2-methylbenzoic acid 江苏永安化工有限公司 2022-01-18 CN claimed
EP-0927714-A1 PROCESS FOR THE SEPARATION OF NITROTOLUIC ACID ISOMERS SUMIKIN CHEMICAL CO., LTD. (JP) 1999-07-07 EP claimed
CN-1203905-A New process for synthetising m-nitrobenzoic JINHAI CHEMICAL PLANT LIAOHE P (CN) 1999-01-06 CN claimed
US-5830999-A CARBOXYLIC LIGANDS, HEXAMERS REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-11-03 US claimed
EP-0519971-B1 NOVEL PHARMACEUTICALLY ACTIVE COMPOUNDS WHICH CAN BE FORMED FROM 1,3,4,6,7,8-HEXAHYDRO-2H-PYRIMIDO-(1,2-a)-PYRIMIDINE INST SOZIAL MED FORSCHUNG SA (CH) 1997-01-15 EP claimed
EP-0519971-A1 NOVEL PHARMACEUTICALLY ACTIVE COMPOUNDS WHICH CAN BE FORMED FROM 1,3,4,6,7,8-HEXAHYDRO-2H-PYRIMIDO-(1,2-a)-PYRIMIDINE. EEC PHARMA SA (FR) 1992-12-30 EP claimed
WO-1991013886-A1 NOVEL PHARMACEUTICALLY ACTIVE COMPOUNDS WHICH CAN BE FORMED FROM 1,3,4,6,7,8-HEXAHYDRO-2H-PYRIMIDO-(1,2-a)-PYRIMIDINE EEC-PHARMA S.A. (FR) 1991-09-19 WO claimed
EP-0055616-A1 Antibacterial compounds BEECHAM GROUP PLC (GB) 1982-07-07 EP claimed
US-4115430-A PLANT GROWTH INHIBITORS CIBA-GEIGY CORPORATION (US) 1978-09-19 US claimed
US-4065477-A Process for preparing highly pure 1-nitroanthraquinone BISON-WERKE BAHRE & GRETEN GMBH & CO. KG (US) 1977-12-27 US claimed
US-3935005-A Composition and method for stripping gold and silver AMERICAN CHEMICAL & REFINING COMPANY, INCORPORATED (US) 1976-01-27 US claimed