SCHEMBL25879650

SCHEMBL25879650

O=c1cc2nc3ccc(=O)c(=O)c3nc2cc1=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.33
NQO2 P16083 6/20 0.32
MAPT P10636 3/20 0.32
POLB P06746 2/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 2/20 0.32
THRB P10828 2/20 0.32
BLM P54132 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CASP6 P55212 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDR P35968 1/20 0.31
PKM P14618 2/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
G6PD P11413 1/20 0.31
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
GLA P06280 1/20 0.30

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
SCHEMBL21297318 0.61 MAPT (0.40) NQO2MAPTPOLBRAB9AMEN1
SCHEMBL1959323 0.59 PAX8 (0.32) MAPTALDH1A1LMNA
SCHEMBL15498095 0.59 MYC (0.34) CYP2C19NQO2MAPTPOLBRAB9A
SCHEMBL25299764 0.58 PAX8 (0.33)
SCHEMBL4654883 0.57 MAPT (0.69) NQO2MAPTPOLBRAB9AMEN1
SCHEMBL13156543 0.56 PRMT5 (0.54) NQO2MAPTRAB9AALDH1A1SMN1; SMN2
SCHEMBL1755060 0.56 MYC (0.41) CYP2C19NQO2MAPTPOLBRAB9A
SCHEMBL1755055 0.56 MYC (0.41) CYP2C19NQO2MAPTPOLBRAB9A
SCHEMBL6858113 0.56 MAPT (0.52) NQO2MAPTPOLBRAB9AMEN1
SCHEMBL13156514 0.56 PRMT5 (0.54) NQO2MAPTRAB9AALDH1A1SMN1; SMN2

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
US-20230238534-A1 ACTIVE MATERIAL FOR SECONDARY BATTERIES, ELECTRODE FOR SECONDARY BATTERIES, SECONDARY BATTERY AND FLIGHT VEHICLE NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2023-07-27 US disclosed
US-20230238534-A1 ACTIVE MATERIAL FOR SECONDARY BATTERIES, ELECTRODE FOR SECONDARY BATTERIES, SECONDARY BATTERY AND FLIGHT VEHICLE NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2023-07-27 US disclosed