SCHEMBL4710751

SCHEMBL4710751

O=C(O)c1cnn2c(-c3ccccc3)c(-c3ccc(F)cc3)cnc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.57
STAT1 P42224 2/20 0.45
KDR P35968 1/20 0.45
ALDH1A1 P00352 7/20 0.44
KMT2A Q03164 7/20 0.44
MEN1 O00255 6/20 0.44
MAPT P10636 3/20 0.44
HPGD P15428 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
CASP3 P42574 1/20 0.44
BLM P54132 1/20 0.44
NCOA1 Q15788 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
GAA P10253 1/20 0.43
NPC1 O15118 9/20 0.43
RAB9A P51151 9/20 0.43
SMN1; SMN2 Q16637 4/20 0.43

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
SCHEMBL4275323 0.87 RAB9A (0.57) KDM4EKDRALDH1A1KMT2AMEN1
SCHEMBL4708839 0.85 PTPN1 (0.44) KDM4ESTAT1KDRALDH1A1KMT2A
SCHEMBL14014492 0.85 KDM4E (0.49) KDM4ESTAT1KDRALDH1A1KMT2A
SCHEMBL14014409 0.85 KDM4E (0.49) KDM4ESTAT1KDRALDH1A1KMT2A
SCHEMBL4707200 0.85 KDR (0.44) KDM4ESTAT1KDRALDH1A1KMT2A
SCHEMBL4708706 0.84 PTGS2 (0.49) KDR
SCHEMBL4708603 0.83 KDR (0.42) KDM4ESTAT1KDRALDH1A1KMT2A
SCHEMBL4272298 0.83 RAB9A (0.61) KDM4EKDRALDH1A1KMT2AMEN1
SCHEMBL4707740 0.82 KDR (0.42) KDM4ESTAT1KDRALDH1A1KMT2A
SCHEMBL14014486 0.81 MCL1 (0.48) KDM4EALDH1A1MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1511751-B1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS ANTIVIRAL AGENTS NEOGENESIS PHARMACEUTICALS INC (US) 2008-03-19 EP disclosed
EP-1511751-A1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUNDS AS ANTIVIRAL AGENTS Neogenesis Pharmaceuticals, Inc. (US) 2005-03-09 EP disclosed
WO-2003101993-A1 PYRAZOLO` 1,5A! PYRIMIDINE COMPOUNDS AS ANTIVIRAL AGENTS NEOGENESIS PHARMACEUTICALS, INC. (US) 2003-12-11 WO disclosed