SCHEMBL5593344

SCHEMBL5593344

Cc1cc(F)c(-c2c(C)nc3ncnn3c2N2CCC(C)CC2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.44
ALDH1A1 P00352 5/20 0.44
PAX2 Q02962 1/20 0.41
TSHR P16473 6/20 0.40
NPSR1 Q6W5P4 3/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 5/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HTT P42858 2/20 0.38
ALOX15 P16050 2/20 0.37
MAPK1 P28482 2/20 0.37
PDE2A O00408 2/20 0.37
EGLN2 Q96KS0 1/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL5593201 0.95 EGLN2 (0.41) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5593427 0.89 ALDH1A1 (0.41) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5593160 0.89 LMNA (0.43) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5593192 0.88 PAX2 (0.43) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5593199 0.88 LMNA (0.40) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5593364 0.88 LMNA (0.42) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5593422 0.87 EGLN2 (0.41) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5746797 0.86 PAX2 (0.47) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5593438 0.85 EGLN2 (0.39) LMNAALDH1A1PAX2TSHRNPSR1
SCHEMBL5593488 0.84 PDE2A (0.41) LMNAALDH1A1PAX2TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007099092-A1 SUBSTITUTED 6-PHENYL-7-AMINO[1,2,4]-TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE FOR CONTROLLING PATHOGENIC FUNGI BASF SE (DE) 2007-09-07 WO claimed
WO-2007099092-A1 SUBSTITUTED 6-PHENYL-7-AMINO[1,2,4]-TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE FOR CONTROLLING PATHOGENIC FUNGI BASF SE (DE) 2007-09-07 WO disclosed