SCHEMBL973982

SCHEMBL973982

O=C(Cl)c1cc([N+](=O)[O-])c(F)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
VCAM1 P19320 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HIF1A Q16665 1/20 0.41
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
GPR35 Q9HC97 2/20 0.39
ESPL1 Q14674 1/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP3A4 P08684 1/20 0.38
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL1014802 0.86 TSHR (0.44) NPC1RAB9AATMTDP1VCAM1
SCHEMBL2924145 0.86 VCAM1 (0.45) NPC1RAB9AATMTDP1VCAM1
SCHEMBL1966853 0.86 TDP1 (0.44) RAB9AATMTDP1VCAM1ALDH1A1
SCHEMBL10483678 0.85 VCAM1 (0.46) TDP1VCAM1ALDH1A1KMT2AGPR35
SCHEMBL6586312 0.85 CA12 (0.46) NPC1RAB9AATMTDP1VCAM1
SCHEMBL9878340 0.85 KMT2A (0.53) NPC1RAB9AATMTDP1VCAM1
SCHEMBL31468684 0.85 CA12 (0.46) NPC1RAB9AATMTDP1VCAM1
Hydrochloric Acid SCHEMBL3983490 0.85 TSHR (0.42) NPC1RAB9AATMTDP1VCAM1
SCHEMBL9419239 0.85 NPC1 (0.42) NPC1RAB9AATMTDP1VCAM1
SCHEMBL10562304 0.84 VCAM1 (0.49) VCAM1ALDH1A1KMT2AGPR35MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116178203-B Polyimide containing amide bond and benzonorbornane structure and preparation method thereof 南昌大学 2025-02-14 CN claimed
CN-116178203-A Polyimide containing amide bond and benzonorbornane structure and preparation method thereof 南昌大学 2023-05-30 CN claimed
CN-117551044-B Method for preparing uracil compound containing carboxylic ester fragment 江苏中旗科技股份有限公司 2026-05-19 CN disclosed
EP-4567029-A1 METHOD FOR PREPARING URACIL COMPOUND CONTAINING CARBOXYLATE FRAGMENT Jiangsu Flag Chemical Industry Co., Ltd. (CN) 2025-06-11 EP disclosed
US-20250179030-A1 METHOD FOR PREPARING A URACIL COMPOUND CONTAINING A CARBOXYLATE FRAGMENT JIANGSU FLAG CHEMICAL INDUSTRY CO., LTD. (CN) 2025-06-05 US disclosed
CN-116178203-B Polyimide containing amide bond and benzonorbornane structure and preparation method thereof 南昌大学 2025-02-14 CN disclosed
CN-118206495-A Method for preparing uracil compound containing carboxylic ester fragment 江苏中旗科技股份有限公司 2024-06-18 CN disclosed
CN-117551044-A Method for preparing uracil compound containing carboxylic ester fragment 江苏中旗科技股份有限公司 2024-02-13 CN disclosed
WO-2024027765-A1 METHOD FOR PREPARING URACIL COMPOUND CONTAINING CARBOXYLATE FRAGMENT 江苏中旗科技股份有限公司 2024-02-08 WO disclosed
CN-114478326-B Synthesis method of saflufenacil key intermediate 安徽宁亿泰科技有限公司 2023-10-03 CN disclosed
CN-116178203-A Polyimide containing amide bond and benzonorbornane structure and preparation method thereof 南昌大学 2023-05-30 CN disclosed
US-5135562-A 8-thia-1,6-diazabicyclo[4.3.0]nonane herbicides CIBA-GEIGY CORPORATION (US) 1992-08-04 US disclosed
CN-1059446-A Synergism goods and the method for Selective Control weeds CIBA GEIGY AG (CH) 1992-03-18 CN disclosed
US-5017211-A Herbicides CIBA-GEIGY CORPORATION (US) 1991-05-21 US disclosed
CN-1049770-A Weeding glutaramic acid and its derivative ROHM & HAAS (US) 1991-03-13 CN disclosed
EP-0415641-A1 Substituted glutaramic acids and derivatives ROHM AND HAAS COMPANY (US) 1991-03-06 EP disclosed
EP-0415642-A1 Glutarimides ROHM AND HAAS COMPANY (US) 1991-03-06 EP disclosed
US-4941909-A HERBICIDES, PYRIMIDONE BENZOATES HOFFMANN-LA ROCHE INC. (US) 1990-07-17 US disclosed
EP-0323487-A1 HETEROCYCLIC COMPOUNDS. HOFFMANN LA ROCHE (CH) 1989-07-12 EP disclosed
WO-1988010254-A1 HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) 1988-12-29 WO 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 (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-20250179030-A1 METHOD FOR PREPARING A URACIL COMPOUND CONTAINING A CARBOXYLATE FRAGMENT UNG, DPYD, DDT NPC1 4828/4885RAB9A 3485/4885ATM 3541/4885

“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.