SCHEMBL138641

SCHEMBL138641

O=[N+]([O-])c1cc(Cl)c(F)cc1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.50
ATM Q13315 1/20 0.50
ALDH1A1 P00352 7/20 0.48
HIF1A Q16665 2/20 0.48
VCAM1 P19320 3/20 0.46
TSHR P16473 4/20 0.45
MAPK1 P28482 1/20 0.45
ESPL1 Q14674 1/20 0.44
SLC6A4 P31645 1/20 0.43
CYP3A4 P08684 2/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
TXNRD1 Q16881 1/20 0.42
TXNRD3 Q86VQ6 1/20 0.42
TXNRD2 Q9NNW7 1/20 0.42
MAPT P10636 2/20 0.42
GPR35 Q9HC97 2/20 0.41
MITF O75030 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL30953155 1.00 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL29739925 0.91 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL432601 0.91 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL29580289 0.89 TDP1 (0.52) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL14578462 0.89 TDP1 (0.52) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL123793 0.89 TDP1 (0.52) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL9694173 0.87 TSHR (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL45486 0.84 TDP1 (0.60) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL30434858 0.83 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL8967138 0.83 TDP1 (0.50) 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 201 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118955296-A Method for preparing 2, 4-difluoroaniline and 2,3, 4-trifluoroaniline by using 3, 4-dichloronitrobenzene as raw material 山东国邦药业有限公司 2024-11-15 CN claimed
CN-106573917-A Method for synthesizing fluoroclozapine and derivatives thereof 瓦伦帝克有限责任公司 2017-04-19 CN claimed
EP-0655997-B1 PYRIDINIUM INTERMEDIATES AND THE PROCESS FOR PREPARING THE SAME ABBOTT LAB (US) 1997-02-12 EP claimed
EP-0655997-A1 PYRIDINIUM INTERMEDIATES AND THE PROCESS FOR PREPARING THE SAME. ABBOTT LAB (US) 1995-06-07 EP claimed
EP-0562435-B1 Process for the preparation of 3,5-difluoroaniline HOECHST AG (DE) 1995-06-07 EP claimed
EP-0655997-A4 PYRIDINIUM INTERMEDIATES AND THE PROCESS FOR PREPARING THE SAME. ABBOTT LAB (US) 1995-02-10 EP claimed
US-5294742-A Process for preparing 3,5-difluoroaniline HOECHST ATKIENGESELLSCHAFT (DE) 1994-03-15 US claimed
US-5294721-A Reacting a halonitrobenzene and a pyridinium salt ABBOTT LABORATORIES (US) 1994-03-15 US claimed
WO-1994004502-A1 PYRIDINIUM INTERMEDIATES AND THE PROCESS FOR PREPARING THE SAME ABBOTT LABORATORIES (US) 1994-03-03 WO claimed
EP-0562435-A1 Process for the preparation of 3,5-difluoroaniline HOECHST AKTIENGESELLSCHAFT (DE) 1993-09-29 EP claimed
US-4642399-A REACTION OF CHLORONITRO BENZENE COMPOUNDS WITH FLUORIDE SALT MALLINCKRODT, INC. (US) 1987-02-10 US claimed
US-4418229-A DISPLACEMENT OF CHLORONITROBENZENES WITH A FLUORIDE SALT, QUATERNARY AMMONIUM PHASE TRANSFER CATALYSTS MALLINCKRODT, INC. (US) 1983-11-29 US claimed
EP-0001825-B1 METHOD OF PREPARING 2,4-DIFLUOROANILINE MERCK & CO. INC. (US) 1982-01-13 EP claimed
US-4294988-A Method of preparing 2,4-difluoroaniline MERCK & CO., INC. (US) 1981-10-13 US claimed
EP-0001825-A1 Method of preparing 2,4-difluoroaniline MERCK & CO. INC. (US) 1979-05-16 EP claimed
US-4140719-A Solid-liquid phase transfer catalysis improved method of preparing 2,4-difluoroaniline MERCK & CO., INC. (US) 1979-02-20 US claimed
JP-6041026-A None JP disclosed
US-12559492-B2 BRAF degraders C4 THERAPEUTICS, INC. (US) 2026-02-24 US disclosed
US-4140719-A Solid-liquid phase transfer catalysis improved method of preparing 2,4-difluoroaniline MERCK & CO., INC. (US) 1979-02-20 US disclosed
US-4140719-A Solid-liquid phase transfer catalysis improved method of preparing 2,4-difluoroaniline MERCK & CO., INC. (US) 1979-02-20 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 (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-12559492-B2 BRAF degraders BRAF, NRAS, HRAS TDP1 1294/4885ATM 3560/4885ALDH1A1 2764/4885

“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.