SCHEMBL19918540

SCHEMBL19918540

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4oc5ccc(-n6c7ccccc7c7cc(-c8ccc9oc%10cc%11c%12c(cccc%12c%10c9c8)-c8ccccc8-%11)ccc76)cc5c4c3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAC2 P15153 1/20 0.31
RAC3 P60763 1/20 0.31
CDC42 P60953 1/20 0.31
RAC1 P63000 1/20 0.31
PLA2G10 O15496 1/20 0.30
PLA2G2A P14555 1/20 0.30
PLA2G4A P47712 1/20 0.30
TSPO P30536 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
SCHEMBL19918566 0.96 L3MBTL1 (0.33) RAC2RAC3CDC42RAC1PLA2G10
SCHEMBL19918569 0.95 L3MBTL1 (0.33) PLA2G10PLA2G2APLA2G4ATSPO
SCHEMBL19918689 0.93
SCHEMBL19918635 0.92 KDM4E (0.33) TSPO
SCHEMBL19918573 0.91 PLA2G2A (0.32) PLA2G10PLA2G2APLA2G4ATSPO
SCHEMBL19918567 0.91 HPSE (0.32) PLA2G10PLA2G2APLA2G4ATSPO
SCHEMBL19918685 0.90 CHEK2 (0.33) PLA2G10PLA2G2APLA2G4ATSPO
SCHEMBL19918534 0.90 TSPO (0.33) PLA2G10PLA2G2APLA2G4ATSPO
SCHEMBL19918564 0.90 HSP90AA1 (0.33) PLA2G10PLA2G2APLA2G4A
SCHEMBL19918576 0.90 L3MBTL1 (0.39) PLA2G10PLA2G2APLA2G4ATSPO

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
WO-2018038400-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME 주식회사 두산 2018-03-01 WO disclosed