SCHEMBL1637641

SCHEMBL1637641

Nc1cc(F)cc(F)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.35
CYP3A4 P08684 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL1462101 0.86 GAA (0.40) ALDH1A1GAACYP3A4
SCHEMBL1043332 0.80 CES2 (0.36) ALDH1A1CYP3A4CES2CES1
SCHEMBL1041423 0.79 CYP3A4 (0.39) ALDH1A1GAACYP3A4
Phosphine SCHEMBL28192224 0.77 CES2 (0.35) ALDH1A1CYP3A4CES2CES1
Hydrogen Sulfide SCHEMBL28335379 0.77 CES2 (0.35) ALDH1A1CYP3A4CES2CES1
SCHEMBL8873189 0.76 GAA (0.36) ALDH1A1GAACYP3A4
SCHEMBL23205852 0.75 CD44 (0.41) ALDH1A1GAACYP3A4
SCHEMBL1494369 0.75 GAA (0.34) ALDH1A1GAA
SCHEMBL9153454 0.74 GRIN2D (0.36) ALDH1A1GAACYP3A4
Hydrochloric Acid SCHEMBL1494535 0.73 GAA (0.33) ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0497213-B1 Process for producing 3,5-difluoroaniline ISHIHARA SANGYO KAISHA (JP) 1995-09-27 EP claimed
US-5399767-A Process for producing 3,5-difluoraniline ISHIHARA SANGYO KAISHA LTD. (JP) 1995-03-21 US claimed
EP-0497213-A2 Process for producing 3,5-difluoroaniline ISHIHARA SANGYO KAISHA, LTD. (JP) 1992-08-05 EP claimed
JP-5246958-A None JP disclosed
JP-5065250-A None JP disclosed
EP-3532474-B1 4,5-ANNULATED 1,2,4-TRIAZOLONES BAYER AG (DE) 2024-03-27 EP disclosed
CN-114921391-B 4, 5-cyclic 1,2, 4-triazolones 拜耳股份有限公司 2024-01-02 CN disclosed
US-11787797-B2 4,5-annulated 1,2,4-triazolones BAYER AKTIENGESELLSCHAFT (DE) 2023-10-17 US disclosed
CN-114921391-A 4, 5-Cyclic 1,2, 4-triazolones 拜耳股份有限公司 2022-08-19 CN disclosed
CN-110248937-B 4, 5-Cyclic 1,2, 4-triazolones 拜耳股份有限公司 2022-03-29 CN disclosed
CN-108250199-B Dihydropyridone P1 as factor XIA inhibitor 百时美施贵宝公司 2021-07-16 CN disclosed
US-5510533-A Process for producing 3,5-difluoroaniline and derivative thereof SDS BIOTECH K.K. (JP) 1996-04-23 US disclosed
EP-0460639-B1 Process for producing 3,5-difluoroaniline and derivative thereof SDS BIOTECH CORP (JP) 1995-12-27 EP disclosed
EP-0497213-B1 Process for producing 3,5-difluoroaniline ISHIHARA SANGYO KAISHA (JP) 1995-09-27 EP disclosed
US-5399767-A Process for producing 3,5-difluoraniline ISHIHARA SANGYO KAISHA LTD. (JP) 1995-03-21 US disclosed
EP-0596130-A1 PRODUCTION OF 2-HALO-3,5-DIFLUOROANILINE, INTERMEDIATE FOR PRODUCING THE SAME, AND PRODUCTION OF SAID INTERMEDIATE SDS Biotech K.K. (JP) 1994-05-11 EP disclosed
JP-H05246958-A PRODUCTION OF 3,5-DIFLUROANILINE SDS BIOTECH KK 1993-09-24 JP disclosed
JP-H0565250-A PRODUCTION OF 3,5-DIFLUOROANILINE ISHIHARA SANGYO KAISHA LTD 1993-03-19 JP disclosed
EP-0497213-A2 Process for producing 3,5-difluoroaniline ISHIHARA SANGYO KAISHA, LTD. (JP) 1992-08-05 EP disclosed
EP-0460639-A1 Process for producing 3,5-difluoroaniline and derivative thereof SDS Biotech K.K. (JP) 1991-12-11 EP 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-11787797-B2 4,5-annulated 1,2,4-triazolones CCNA1, CCNT1, CCND2 ALDH1A1 274/4885GAA 1917/4885CYP3A4 99/4885

“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.