SCHEMBL177231

SCHEMBL177231

Cc1ccc(C(=O)O)cc1[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
CES2 O00748 1/20 0.71
CES1 P23141 1/20 0.71
CASP6 P55212 1/20 0.70
LMNA P02545 1/20 0.64
HCAR3 P49019 8/20 0.63
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
POLB P06746 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
GAA P10253 1/20 0.56
CTDSP1 Q9GZU7 1/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
ALDH1A1 P00352 1/20 0.56
MAPT P10636 1/20 0.56

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
SCHEMBL30668892 1.00 TSHR (1.00) TSHRCES2CES1CASP6LMNA
Hydrochloric Acid SCHEMBL11517993 0.98 TSHR (0.96) TSHRCES2CES1CASP6LMNA
Ammonia Solution, Strong SCHEMBL27660564 0.98 TSHR (0.96) TSHRCES2CES1CASP6LMNA
Diethylamine SCHEMBL28105871 0.89 TSHR (0.79) TSHRCES2CES1CASP6LMNA
Diethylamine SCHEMBL28029754 0.88 TSHR (0.77) TSHRCES2CES1CASP6LMNA
SCHEMBL17303445 0.87 TSHR (0.77) TSHRCES2CES1LMNAMEN1
SCHEMBL1978668 0.87 TSHR (0.75) TSHRCES2CES1CASP6LMNA
SCHEMBL12228039 0.86 TSHR (0.76) TSHRCES2CES1CASP6LMNA
SCHEMBL30041934 0.85 TSHR (0.74) TSHRCES2CES1LMNAMEN1
SCHEMBL571521 0.85 TSHR (0.74) TSHRCES2CES1LMNAMEN1

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 973 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-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
CN-118515568-B Preparation method of 3-chloro-2-methylaniline 天津深蓝工程技术有限公司 2024-09-17 CN claimed
CN-118515568-A Preparation method of 3-chloro-2-methylaniline 天津深蓝工程技术有限公司 2024-08-20 CN claimed
WO-2024167565-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS PURDUE RESEARCH FOUNDATION (US) 2024-08-15 WO 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
EP-3692101-B1 BRILLIANT BLUE (BBG) DYE DERIVATIVES AND STAINING COMPOSITIONS COMPRISING THE SAME FOR SELECTIVELY STAINING BIOLOGICAL SUBSTRATES ALFA INSTR S R L (IT) 2022-01-12 EP claimed
CN-112745300-A Method for preparing N- (5-carboxyl-2-methylphenyl) -4- (3-pyridine) -2-pyrimidinamine 杭州浙中医药科技有限公司 2021-05-04 CN claimed
CN-112250796-A Preparation method of BX/SGPS nitro-p-methyl benzoate-g-AM/MA 桂林理工大学 2021-01-22 CN claimed
CN-112175140-A Synthesis method of active BX/SGPS quaternary graft copolymerization derivative 桂林理工大学 2021-01-05 CN claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-20050090690-A1 Process for preparing tetra-amide compounds XEROX CORPORATION 2005-04-28 US claimed
WO-2003102153-A2 CELL MIGRATION INHIBITING COMPOSITIONS AND METHODS AND COMPOSITIONS FOR TREATING CANCER AVOLIX PHARMACEUTICALS (US) 2003-12-11 WO claimed
US-RE34272-E Oxalic acid, a thiocyanate salt, and a nitrobenzenesulfonate salt REM CHEMICALS, INC. (US) 1993-06-08 US claimed
EP-0395815-B1 METHOD AND COMPOSITION FOR REFINEMENT OF METAL SURFACES REM CHEMICALS, INC. (US) 1993-06-02 EP claimed
US-5191010-A Emulsion having dye developing property NIPPON ZEON CO., LTD. (JP) 1993-03-02 US claimed
EP-0395815-A1 Method and composition for refinement of metal surfaces REM CHEMICALS, INC. (US) 1990-11-07 EP claimed
US-4906327-A Method and composition for refinement of metal surfaces REM CHEMICALS, INC. (US) 1990-03-06 US claimed
US-4601920-A DISSOLVING METAL AROMATIC CARBOXYLATE IN ORGANIC SOLVENT FUJI PHOTO FILM CO., LTD. (JP) 1986-07-22 US claimed
US-4159208-A REACTING ALKALI METAL SALT OF AN AROMATIC CARBOXYLIC ACID AND A METAL SALT IN THE PRESENCE OF CLAY AND ALUMINUM COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1979-06-26 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050090690-A1 Process for preparing tetra-amide compounds TAF9, TAF5, TAF1 TSHR 4082/4885CES2 2351/4885CES1 3786/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.