SCHEMBL16613432

SCHEMBL16613432

CC1(C)C=Cc2c(-c3cccc(-c4ccccc4)c3)nc(-n3c4ccccc4c4ccccc43)nc21

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL16613334 0.94
SCHEMBL16613675 0.92 PTGER4 (0.35)
SCHEMBL16613413 0.92 KDM4E (0.33) MAPT
SCHEMBL16613476 0.92 KDM4E (0.34) MAPT
SCHEMBL16613754 0.91 TUBB4A (0.37)
SCHEMBL16613434 0.89 TUBB4A (0.34)
SCHEMBL16613760 0.88 PTGER4 (0.35)
SCHEMBL16613809 0.87 KDM4E (0.36)
SCHEMBL16613745 0.86 KDM4E (0.37)
SCHEMBL16613746 0.85 PTGER4 (0.32)

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