SCHEMBL22937153

SCHEMBL22937153

Brc1ccc2c(c1)c1cccc3c4cccc5cccc(c54)n2c31

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSPO P30536 2/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CYP1A2 P05177 3/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
MAPT P10636 3/20 0.33
RAD52 P43351 1/20 0.33
THRB P10828 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP2A6 P11509 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
ERBB2 P04626 1/20 0.32
FYN P06241 1/20 0.32
MAOA P21397 1/20 0.32
ACHE P22303 1/20 0.32
AHR P35869 1/20 0.32
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31

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 0.87 CYP1A2 (0.39) TSPOMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL29649844 0.85 TSPO (0.44) TSPOMEN1KMT2AALDH1A1HPGD
SCHEMBL15453212 0.85 TSPO (0.44) TSPOMEN1KMT2AALDH1A1HPGD
SCHEMBL22937151 0.85 TSPO (0.33) TSPOMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL20071703 0.83 TSPO (0.36) TSPOMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL22109872 0.81 CYP2A6 (0.39) TSPOMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL20071437 0.81 CYP2A6 (0.37) TSPOMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL20465300 0.79 CYP2A6 (0.41) TSPOMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL22109881 0.79 CYP1A2 (0.40) TSPOMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL20086168 0.78 TSPO (0.44) TSPOMEN1KMT2AALDH1A1HPGD

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-2021020873-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-04 WO disclosed