SCHEMBL22136384

SCHEMBL22136384

Brc1ccc2c(c1)c1ccc3cc(N(c4ccccc4)c4ccccc4)cc4c5ccccc5n2c1c34

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSPO P30536 3/20 0.37
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RAD52 P43351 1/20 0.32
RXFP1 Q9HBX9 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 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
SCHEMBL22109813 0.80 CYP1A2 (0.39) TSPOMEN1KMT2ARAD52RXFP1
SCHEMBL22136390 0.79 ALKBH5 (0.34) TSPOMEN1KMT2AMAPT
SCHEMBL22109534 0.77 TSPO (0.34) TSPO
SCHEMBL18239160 0.77 KDM4E (0.36) TSPOMEN1KMT2AMAPT
SCHEMBL20444361 0.75 TSPO (0.35) TSPO
SCHEMBL15595210 0.75 L3MBTL1 (0.43) TSPOMEN1KMT2ARAD52RXFP1
SCHEMBL20444716 0.74 TSPO (0.39) TSPO
SCHEMBL21710579 0.74 KDM4E (0.38) TSPOMEN1KMT2AMAPT
SCHEMBL23821019 0.73 KDM4E (0.36) MEN1KMT2AMAPT
SCHEMBL15453212 0.73 TSPO (0.44) TSPOMEN1KMT2ARAD52TP53

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-2020130378-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2020-06-25 WO disclosed