SCHEMBL15089415

SCHEMBL15089415

c1ccc(-c2cc(-c3ccccn3)nc(N3c4cc5sc6ccccc6c5cc4-c4cccc5c(-c6ccccn6)ccc3c45)c2)nc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 3/20 0.33
TGFBR1 P36897 1/20 0.33
MIF P14174 1/20 0.32
GABRA1 P14867 1/20 0.32
HTR2C P28335 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
SCHEMBL15089334 0.88 ALDH1A1 (0.39) TGFBR1MIFGABRA1HTR2C
SCHEMBL15089405 0.86 COMT (0.32)
SCHEMBL15089335 0.82 MIF (0.32) TGFBR1MIFGABRA1HTR2C
SCHEMBL15089378 0.80 CNR2 (0.36) TGFBR1MIFGABRA1HTR2C
SCHEMBL15088987 0.79 HTR2C (0.33) METAP1HTR2C
SCHEMBL15089217 0.79 METAP1 (0.33) METAP1
SCHEMBL15089333 0.76 KDM4E (0.45) MIFGABRA1
SCHEMBL15089183 0.76 PDE6D (0.37)
SCHEMBL15089418 0.74 TSHR (0.32) MIFGABRA1
SCHEMBL15089404 0.74 PDE6D (0.37)

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-2013100497-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2013-07-04 WO disclosed