SCHEMBL5593345

SCHEMBL5593345

Cc1cc(F)c(-c2c(C#N)nc3ncnn3c2N2CCCCCC2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 10/20 0.42
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36
KMT2A Q03164 1/20 0.36
PAX2 Q02962 1/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
HPGD P15428 1/20 0.35
PDE2A O00408 3/20 0.35
LMNA P02545 1/20 0.34
ALOX15 P16050 1/20 0.34

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
SCHEMBL5593422 0.89 EGLN2 (0.41) EGLN2ALDH1A1TDP1MEN1GAA
SCHEMBL5593381 0.89 EGLN2 (0.41) EGLN2ALDH1A1GAATSHRHPGD
SCHEMBL5593191 0.87 ALDH1A1 (0.37) EGLN2ALDH1A1TDP1GAATSHR
SCHEMBL5593085 0.86 EGLN2 (0.46) EGLN2ALDH1A1MEN1KMT2ATSHR
SCHEMBL5593192 0.86 PAX2 (0.43) EGLN2ALDH1A1MEN1KMT2APAX2
SCHEMBL5593080 0.86 EGLN2 (0.43) EGLN2ALDH1A1TDP1MEN1GAA
SCHEMBL5593247 0.84 EGLN2 (0.46) EGLN2PDE2A
SCHEMBL5593122 0.84 PAX2 (0.37) EGLN2ALDH1A1MEN1KMT2APAX2
SCHEMBL5593162 0.82 SMN1; SMN2 (0.40) EGLN2ALDH1A1MEN1KMT2APAX2
SCHEMBL5593433 0.79 EGLN2 (0.39) EGLN2ALDH1A1TDP1MEN1GAA

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