SCHEMBL11549367

SCHEMBL11549367

O=C(O)c1nc2nc3ccccc3cc2c(=O)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 3/20 0.50
TOP2B Q02880 3/20 0.50
KMT2A Q03164 3/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
BRD4 O60885 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
USP2 O75604 1/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GUSB P08236 2/20 0.41
PARP1 P09874 3/20 0.41
TNKS2 Q9H2K2 2/20 0.41
QTRT1 Q9BXR0 1/20 0.41
PARP2 Q9UGN5 1/20 0.40
MGAM O43451 2/20 0.40

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
SCHEMBL11548431 0.87 TOP2A (0.46) TOP2ATOP2BKMT2AGAAMAPT
SCHEMBL11552470 0.86 TOP2A (0.45) TOP2ATOP2BKMT2AGAAMAPT
SCHEMBL11549102 0.83 PDE3B (0.43) TOP2ATOP2BKMT2AMAPTKDM4E
SCHEMBL11547661 0.80 RAB9A (0.46) TOP2ATOP2BKMT2AGAAMAPT
SCHEMBL11548593 0.80 KDM4E (0.59) TOP2ATOP2BKMT2AGAAMAPT
SCHEMBL11547964 0.80 MMP13 (0.44) KMT2AGAAMAPTKDM4EALDH1A1
SCHEMBL29965486 0.79 TOP2A (0.58) TOP2ATOP2BKMT2AMAPTBRD4
SCHEMBL4936991 0.79 TOP2A (0.58) TOP2ATOP2BKMT2AMAPTBRD4
SCHEMBL11601485 0.78 CYP3A4 (0.42) TOP2ATOP2BMAPTBRD4KDM4E
SCHEMBL11546486 0.77 KDM4E (0.64) KMT2AGAAMAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-4011324-A Esters and amides of pyrimido[4,5-b]quinolin-4(3H)-one-2-carboxylic acids as antiulcer agents PFIZER INC. (US) 1977-03-08 US disclosed
US-4011324-A Esters and amides of pyrimido[4,5-b]quinolin-4(3H)-one-2-carboxylic acids as antiulcer agents PFIZER INC. (US) 1977-03-08 US disclosed
US-4011324-A Esters and amides of pyrimido[4,5-b]quinolin-4(3H)-one-2-carboxylic acids as antiulcer agents PFIZER INC. (US) 1977-03-08 US disclosed
US-3974161-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1976-08-10 US disclosed