SCHEMBL7495293

SCHEMBL7495293

Fc1ccc(F)c(-c2c(Cl)nc3ncnn3c2Cl)c1F

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
POLB P06746 3/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 2/20 0.41
KDM4E B2RXH2 5/20 0.40
HPGD P15428 2/20 0.40
MBOAT4 Q96T53 1/20 0.36
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL5622818 0.87 ALDH1A1 (0.39) ALDH1A1POLBKMT2ATSHRKDM4E
SCHEMBL5236413 0.83 ALDH1A1 (0.40) ALDH1A1POLBKMT2ATSHRMBOAT4
SCHEMBL8131234 0.81 ALDH1A1 (0.48) ALDH1A1POLBKMT2ATSHRKDM4E
SCHEMBL3276173 0.81 ALDH1A1 (0.39) ALDH1A1POLBKMT2ATSHRKDM4E
SCHEMBL4816609 0.80 ALDH1A1 (0.37) ALDH1A1POLBKMT2ATSHRKDM4E
SCHEMBL7488259 0.80 ALDH1A1 (0.37) ALDH1A1POLBKMT2ATSHRKDM4E
SCHEMBL7490417 0.80 ALDH1A1 (0.37) ALDH1A1POLBKMT2ATSHRKDM4E
SCHEMBL4814986 0.79 ALDH1A1 (0.38) ALDH1A1POLBKMT2ATSHRKDM4E
SCHEMBL7494211 0.79 LMNA (0.40) ALDH1A1POLBKMT2ATSHRKDM4E
SCHEMBL4811365 0.79 ALDH1A1 (0.35) ALDH1A1POLBKMT2ATSHRKDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11322750-A None JP disclosed
EP-0945453-B1 Fungicidal trifluorophenyl-triazolopyrimidines BASF AG (DE) 2002-11-20 EP disclosed
US-6117865-A FOR CONTROLLING FUNGUS IN PLANTS AMERICAN CYANAMID COMPANY (US) 2000-09-12 US disclosed
JP-H11322750-A BACTERICIDAL AND FUNGICIDAL TRIFLUOROPHENYL-TRIAZOLOPYRIMIDINE AMERICAN CYANAMID CO 1999-11-24 JP disclosed
EP-0945453-A1 Fungicidal trifluorophenyl-triazolopyrimidines American Cyanamid Company (US) 1999-09-29 EP disclosed