SCHEMBL25879666

SCHEMBL25879666

O=c1ccc(=O)c2cc3nc4c(=O)ccc(=O)c4nc3cc12

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.34
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
NQO2 P16083 1/20 0.31
CCR8 P51685 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HCRTR1 O43613 1/20 0.30
MAPT P10636 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
KMT2A Q03164 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
SCHEMBL25299764 0.74 PAX8 (0.33) PAX8
SCHEMBL1887304 0.71 CCR8 (0.43) PAX8CA1CA2CCR8KMT2A
SCHEMBL16532965 0.64 PAX8 (0.48) PAX8CA1CA2CCR8KDM4E
SCHEMBL1755055 0.61 MYC (0.41) NQO2MAPTCASP1CASP7KMT2A
SCHEMBL1755060 0.61 MYC (0.41) NQO2MAPTCASP1CASP7KMT2A
SCHEMBL13156573 0.58 MYC (0.48) NQO2KDM4EMAPTCASP1CASP7
SCHEMBL15498095 0.58 MYC (0.34) NQO2CCR8KDM4EMAPTCASP1
SCHEMBL29512047 0.58 NQO2 (0.52) NQO2KDM4EMAPTKMT2A
SCHEMBL2245783 0.58 NQO2 (0.52) NQO2KDM4EMAPTKMT2A
SCHEMBL11730576 0.57 NQO2 (0.50) NQO2CCR8KDM4EHCRTR1MAPT

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