SCHEMBL641867

SCHEMBL641867

O=C(Cl)Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.57
CYP1A2 P05177 1/20 0.57
ALDH1A1 P00352 8/20 0.57
MAPT P10636 3/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
HTT P42858 2/20 0.55
TSHR P16473 1/20 0.55
GAA P10253 1/20 0.54
PKM P14618 1/20 0.54
LOXL2 Q9Y4K0 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CES1 P23141 1/20 0.50
GLA P06280 1/20 0.49
KDM4E B2RXH2 1/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL3344816 0.86 CYP2C19 (0.56) CYP2C19CYP1A2ALDH1A1MAPTMEN1
SCHEMBL6932662 0.83 CYP2C19 (0.61) CYP2C19CYP1A2ALDH1A1MAPTMEN1
SCHEMBL9698823 0.82 TSHR (0.53) CYP2C19CYP1A2ALDH1A1MAPTMEN1
SCHEMBL7693596 0.82 TSHR (0.53) CYP2C19CYP1A2ALDH1A1MAPTMEN1
SCHEMBL76204 0.82 CYP2C19 (0.64) CYP2C19CYP1A2ALDH1A1MAPTMEN1
Silver SCHEMBL11309103 0.82 CYP2C19 (0.59) CYP2C19CYP1A2ALDH1A1MAPTMEN1
SCHEMBL30643815 0.82 CYP2C19 (0.64) CYP2C19CYP1A2ALDH1A1MAPTMEN1
SCHEMBL3089874 0.82 CYP2C19 (0.59) CYP2C19CYP1A2ALDH1A1MAPTMEN1
SCHEMBL1369962 0.82 CYP2C19 (0.59) CYP2C19CYP1A2ALDH1A1MAPTMEN1
SCHEMBL3014336 0.81 CYP2C19 (0.54) CYP2C19CYP1A2ALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114031502-A Preparation method of p-nitroacetophenone 南京一苇医药科技有限公司 2022-02-11 CN claimed
CN-107089954-B Method for synthesizing aminoquinoxaline mixtures 常州市阳光药业有限公司 2020-04-24 CN claimed
CN-107089954-A The method of synthesizing amino quinoxaline mixture 常州市阳光药业有限公司 2017-08-25 CN claimed
EP-1727550-B1 PHARMACEUTICAL COMPOSITION COMPRISING A BENZODIAZEPINE DERIVATIVE AND AN INHIBITOR OF THE RSV FUSION PROTEIN ARROW THERAPEUTICS LTD (GB) 2009-07-29 EP claimed
US-12404249-B2 Heterocyclic derivatives and use thereof C&C RESEARCH LABORATORIES (KR) 2025-09-02 US disclosed
EP-3802495-B1 4-(2-((2-CHLOROQUINOLIN-4-YL)AMINO)ETHYL)BENZENESULFONAMIDE DERIVATIVES AS STAT3 INHIBITORS FOR THE TREATMENT OF CANCER C&C RES LAB (KR) 2025-07-02 EP disclosed
US-12258321-B1 Aryl-1,2,3-triazole compounds, pharmaceutical composition thereof and method for treatment of breast cancer University of Jeddah (SA) 2025-03-25 US disclosed
CN-119241469-A Photoinitiator, photopolymerization composition and application thereof 武汉尚赛光电科技有限公司 2025-01-03 CN disclosed
CN-118271195-A Liquid crystal-like diamine monomer and preparation method thereof, modified polyimide and preparation method thereof 先丰通讯股份有限公司 2024-07-02 CN disclosed
CN-115710202-B Preparation method and application of apataone key intermediate 江西同和药业股份有限公司 2024-05-03 CN disclosed
CN-112204010-B Heterocyclic derivatives and uses thereof C&C新药研究所 2024-03-19 CN disclosed
US-20230287005-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-09-14 US disclosed
US-4029669-A 6-Benzalimino-6-arylthio penicillanic acids and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1977-06-14 US disclosed
US-4029806-A Nitro-β-lactam antibiotics and processes for their preparation and use BAYER AKTIENGESELLSCHAFT (DT) 1977-06-14 US disclosed
US-4026886-A 7-Acyl-7-arylthiocephalosporins E. R. SQUIBB & SONS, INC. (US) 1977-05-31 US disclosed
US-4026709-A Color photographic recording material CIBA-GEIGY AG (CH) 1977-05-31 US disclosed
US-4012518-A PENICILLIN DERIVATIVES AS GROWTH AND FEED UTILIZATION PROMOTERS IN ANIMALS BAYER AKTIENGESELLSCHAFT (DT) 1977-03-15 US disclosed
US-3984432-A PHOSPHONIC ACID AND PHOSPHORIC ACID DERIVATIVES CIBA-GEIGY AG (CH) 1976-10-05 US disclosed
US-3965093-A 6-Arylthio penicillanic acid and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1976-06-22 US disclosed
US-3954744-A ANTIBACTERIAL E. R. SQUIBB & SONS, INC. (US) 1976-05-04 US disclosed

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

For each of this compound's patents that has machine-readable text (3 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-20230287005-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, F12, F3 CYP2C19 66/4885CYP1A2 110/4885ALDH1A1 1847/4885
US-12404249-B2 Heterocyclic derivatives and use thereof STAT3, JAK2, IRF3 CYP2C19 3889/4885CYP1A2 4198/4885ALDH1A1 1899/4885
US-12258321-B1 Aryl-1,2,3-triazole compounds, pharmaceutical composition thereof and method for treatment of breast cancer MCL1, BCL2, BCL2A1 CYP2C19 369/4885CYP1A2 256/4885ALDH1A1 1122/4885

“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.