SCHEMBL16613625

SCHEMBL16613625

c1ccc2c(-c3nc(-n4c5ccccc5c5c6ccccc6ccc54)nc4sccc34)cccc2c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.34
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL16613715 0.96 VCP (0.33) VCP
SCHEMBL16613702 0.91 VCP (0.32) VCP
SCHEMBL16613530 0.91 VCP (0.37) VCPALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL16613714 0.90 VCP (0.34) VCPALDH1A1MAPTHPGD
SCHEMBL16613554 0.90 VCP (0.31) VCP
SCHEMBL16613721 0.89 KDM4E (0.33) VCP
SCHEMBL16613629 0.88 PIK3CD (0.32) VCP
SCHEMBL16613469 0.87 VCP (0.36) VCPALDH1A1MAPTHPGD
SCHEMBL16613563 0.86
SCHEMBL16613532 0.86 VCP (0.36) VCPALDH1A1MAPTHPGDSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed