SCHEMBL7490647

SCHEMBL7490647

Fc1ccc(F)c(-c2c(Cl)nc3ncnn3c2NC2CC2)c1F

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 2/20 0.39
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 3/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PDE2A O00408 3/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
CDK2 P24941 1/20 0.33
MAPKAPK2 P49137 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
SCHEMBL7487750 0.95 MAPK1 (0.37) EGLN2MAPK1ALDH1A1TSHRPOLB
SCHEMBL7490009 0.94 KMT2A (0.38) EGLN2MAPK1ALDH1A1TSHRKMT2A
SCHEMBL7496989 0.94 KMT2A (0.38) EGLN2MAPK1ALDH1A1TSHRKMT2A
SCHEMBL6867351 0.86 LMNA (0.38) EGLN2ALDH1A1TSHRKDM4EHPGD
SCHEMBL7495679 0.83 GABBR2 (0.39) KDM4E
SCHEMBL7958606 0.83 EGLN2 (0.39) EGLN2MAPK1ALDH1A1TSHRKDM4E
SCHEMBL4817675 0.82 LMNA (0.39) MAPK1ALDH1A1TSHRKMT2AKDM4E
SCHEMBL4816384 0.81 CDK2 (0.35) EGLN2MAPK1ALDH1A1TSHRPOLB
SCHEMBL978477 0.81 KMT2A (0.36) EGLN2MAPK1ALDH1A1TSHRKMT2A
SCHEMBL6187065 0.80 SMN1; SMN2 (0.38) EGLN2MAPK1ALDH1A1TSHRKDM4E

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
EP-0945453-B1 Fungicidal trifluorophenyl-triazolopyrimidines BASF AG (DE) 2002-11-20 EP claimed
EP-0945453-A1 Fungicidal trifluorophenyl-triazolopyrimidines American Cyanamid Company (US) 1999-09-29 EP claimed
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
EP-0945453-A1 Fungicidal trifluorophenyl-triazolopyrimidines American Cyanamid Company (US) 1999-09-29 EP disclosed