SCHEMBL14014203

SCHEMBL14014203

O=C(O)c1cc2nc(-c3ccc(Cl)cc3Cl)cc(-c3cccc(F)c3)n2n1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 3/20 0.55
MARS1 P56192 12/20 0.45
HSD17B10 Q99714 1/20 0.45
TTR P02766 1/20 0.44
CNR1 P21554 1/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL14014206 0.92 KDM4E (0.59) KDM4EALDH1A1MARS1HSD17B10TTR
SCHEMBL14014202 0.89 ALDH1A1 (0.69) KDM4EALDH1A1MARS1HSD17B10TP53
SCHEMBL14014205 0.89 MARS1 (0.55) KDM4EALDH1A1MARS1TTRMEN1
SCHEMBL14014186 0.87 KDM4E (0.66) KDM4EALDH1A1HSD17B10TTRTP53
SCHEMBL14014242 0.87 KDM4E (0.62) KDM4EALDH1A1HSD17B10TTRTP53
SCHEMBL14014212 0.87 ALDH1A1 (0.66) KDM4EALDH1A1MARS1HSD17B10TP53
SCHEMBL14014207 0.86 KDM4E (0.60) KDM4EALDH1A1MARS1TTRSMN1; SMN2
SCHEMBL14014208 0.85 KDM4E (0.52) KDM4EALDH1A1MARS1TP53GAA
SCHEMBL14014232 0.85 KDM4E (0.53) KDM4EALDH1A1MARS1HSD17B10TTR
SCHEMBL14014247 0.84 KDM4E (0.78) KDM4EALDH1A1HSD17B10TP53GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed