SCHEMBL8353045

SCHEMBL8353045

COc1ccc2nc(N)c(C(N)=O)cc2c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.74
ALDH1A1 P00352 8/20 0.64
HPGD P15428 5/20 0.64
GLA P06280 2/20 0.64
GAA P10253 2/20 0.64
IKBKB O14920 1/20 0.58
POLB P06746 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
NCF1 P14598 1/20 0.51
PLA2G10 O15496 1/20 0.50
F2 P00734 1/20 0.48
HSD17B10 Q99714 3/20 0.47
HPGDS O60760 1/20 0.47
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
AURKA O14965 1/20 0.44
MET P08581 1/20 0.44
KDR P35968 1/20 0.44
TEK Q02763 1/20 0.44
AURKB Q96GD4 1/20 0.44

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
SCHEMBL3219464 0.80 KDM4E (0.52) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL8352155 0.78 KDM4E (1.00) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL4865999 0.77 NCF1 (0.61) KDM4EALDH1A1HPGDGLAPOLB
SCHEMBL11549068 0.77 IKBKB (0.59) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL11549035 0.76 IKBKB (0.63) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL11548569 0.76 IKBKB (0.63) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL7508287 0.75 KDM4E (0.60) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL6827783 0.75 KDM4E (0.60) KDM4EALDH1A1HPGDGLAPOLB
SCHEMBL22279074 0.75 KDM4E (0.60) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL12478522 0.75 NCF1 (0.54) KDM4EALDH1A1HPGDGLAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5908930-A 5,10-dihydropyrimdo 4,5-b!quinolin-4(1H)-one tyrosine kinase inhibitors PFIZER INC. (US) 1999-06-01 US disclosed
WO-1996028444-A1 5,10-DIHYDROPYRIMIDO[4,5-b]QUINOLIN-4(1H)-ONE TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1996-09-19 WO disclosed
US-4134981-A ANTIALLERGENS PFIZER INC. (US) 1979-01-16 US disclosed
US-4120962-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1978-10-17 US disclosed
US-4044134-A FUSED WITH QUINOLINE OR PYRIDINE, 2-METHYL, ETHYL, OR ACETYL GROUP PFIZER INC. (US) 1977-08-23 US disclosed
US-3974161-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1976-08-10 US disclosed