SCHEMBL57954

SCHEMBL57954

O=[N+]([O-])c1cc(F)c(F)c(F)c1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.48
ATM Q13315 1/20 0.48
ALDH1A1 P00352 6/20 0.47
HIF1A Q16665 3/20 0.47
VCAM1 P19320 1/20 0.44
MAPT P10636 6/20 0.40
PKM P14618 2/20 0.40
ESPL1 Q14674 1/20 0.39
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
RECQL P46063 2/20 0.38
KMT2A Q03164 2/20 0.38
TTR P02766 2/20 0.38
LMNA P02545 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL30616278 1.00 TDP1 (0.48) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL28252592 0.87 TDP1 (0.48) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL1505782 0.82 TDP1 (0.45) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL11797728 0.82 TDP1 (0.45) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL25352334 0.80 GPR35 (0.52) TDP1ALDH1A1HIF1AMAPTPKM
SCHEMBL1193075 0.80 ALDH1A1 (0.46) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL8654973 0.80 ALDH1A1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL25354843 0.80 GPR35 (0.47) TDP1ATMALDH1A1HIF1AMAPT
SCHEMBL8011720 0.80 GPR35 (0.47) TDP1ATMALDH1A1HIF1AMAPT
SCHEMBL8112068 0.80 TDP1 (0.44) TDP1ATMALDH1A1HIF1AVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058596-A Novel synthesis method of key intermediate of cotinamide 仁合益康集团有限公司 2025-05-30 CN claimed
CN-210813976-U Distillation device for producing di-tetra-difluoronitrobenzene 浙江嘉德精细化工有限公司 2020-06-23 CN claimed
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US claimed
US-20100204477-A1 Methods and Processes For Syntheses and Manufacture of Antimicrobial 1(Ortho-Fluorophenyl)dihydropyridones MICURX PHARMACEUTICALS, INC. (KY) 2010-08-12 US claimed
WO-2010091272-A1 METHODS AND PROCESSES FOR SYNTHESES AND MANUFACTURE OF ANTIMICROBIAL 1-(ORTHO-FLUOROPHENYL)DIHYDROPYRIDONES MICURX PHARMACEUTICALS, INC. (US) 2010-08-12 WO claimed
EP-0327504-B1 N-BENZOYL-N'-TRIFLUOROPHENYLUREAS, THEIR PREPARATION AND USE FOR THE CONTROL OF PESTS CIBA-GEIGY AG (CH) 1993-05-12 EP claimed
JP-60222448-A None JP disclosed
EP-4673141-A1 NBD1 MODULATORS AND METHODS OF USING THE SAME Sionna Therapeutics Inc. (US) 2026-01-07 EP disclosed
US-20250368809-A1 RESIN COMPOSITION NAN YA PLASTICS CORPORATION (TW) 2025-12-04 US disclosed
EP-4647127-A2 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS Exelixis, Inc. (US) 2025-11-12 EP disclosed
US-12398226-B2 Resin composition NAN YA PLASTICS CORPORATION (TW) 2025-08-26 US disclosed
US-20250248975-A1 MACROCYCLIC COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF SCHRODINGER, LLC 2025-08-07 US disclosed
EP-3743070-B1 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS EXELIXIS INC (US) 2025-07-23 EP disclosed
EP-0327504-A1 N-Benzoyl-N'-trifluorophenylureas, their preparation and use for the control of pests CIBA-GEIGY AG (CH) 1989-08-09 EP disclosed
CN-1004272-B PYRAZOLINE INSECTICIDES FMC公司 1989-05-24 CN disclosed
EP-0275971-A1 Process and intermediates for quinolonecaboxylic acid KYORIN PHARMACEUTICAL CO., LTD. (JP) 1988-07-27 EP disclosed
US-4657913-A Trifluoro- quinoline -3- carboxylic acids and their use as anti-bacterial agents WARNER-LAMBERT COMPANY (US) 1987-04-14 US disclosed
EP-0202763-A1 5,6-Difluoronaphthyridines and 5,6,8-trifluoro-quinolines as antibacterial agents WARNER-LAMBERT COMPANY (US) 1986-11-26 EP disclosed
JP-S60222448-A ANILINE COMPOUND AND ITS PRODUCTION KYORIN PHARMACEUT CO LTD 1985-11-07 JP disclosed
US-4370278-A Nucleophilic substitution process ETHYL CORPORATION (US) 1983-01-25 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 (2 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-20100204477-A1 Methods and Processes For Syntheses and Manufacture of Antimicrobial 1(Ortho-Fluorophenyl)dihydropyridones DHPS, FDPS, CYP2F1 TDP1 1658/4885ATM 4093/4885ALDH1A1 232/4885
US-20250248975-A1 MACROCYCLIC COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF CFTR, ABCB1, PKD1 TDP1 3209/4885ATM 1441/4885ALDH1A1 3545/4885

“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.