SCHEMBL28613561

SCHEMBL28613561

NC(=O)c1ccc(Cc2ccccc2)c(C(N)=O)n1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 1/20 0.46
PLA2G2A P14555 1/20 0.46
BRD4 O60885 2/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PIM1 P11309 1/20 0.38
BCL2 P10415 1/20 0.38
BCL2L1 Q07817 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
PLK1 P53350 1/20 0.38
CCNA1 P78396 1/20 0.38
ALOX5 P09917 1/20 0.38

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
SCHEMBL27701503 0.84 RECQL (0.46) MEN1KMT2A
SCHEMBL3946630 0.83 ADORA2A (0.45) PLA2G10PLA2G2ABRD4MEN1KMT2A
SCHEMBL30634304 0.81 PLA2G10 (0.50) PLA2G10PLA2G2ABRD4MEN1KMT2A
SCHEMBL21753309 0.80 PLA2G10 (0.42) PLA2G10PLA2G2ABRD4MEN1KMT2A
SCHEMBL9329423 0.80 HCAR2 (0.45) MEN1KMT2ABCL2BCL2L1
SCHEMBL17397579 0.76 CYP2C9 (0.43) KMT2APIM1
SCHEMBL28492022 0.75 KDM4E (0.47) PLA2G10PLA2G2ABCL2BCL2L1
SCHEMBL30006999 0.75 KDM4E (0.47) PLA2G10PLA2G2ABCL2BCL2L1
SCHEMBL28948571 0.75 PIM1 (0.38) MEN1KMT2APIM1
SCHEMBL27892338 0.73 PIM1 (0.37) KMT2APIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113272294-A 2, 6-bis (((1H-benzo [ D ] imidazol-2-yl) thio) methyl) pyridine and N2, N6-dibenzylpyridine-2, 6-dicarboxamide derivatives and related compounds as phosphoinositide 3-kinase (PI3K) inhibitors for the treatment of cancer 雅典学院生物医学研究基金会 2021-08-17 CN disclosed