SCHEMBL29328807

SCHEMBL29328807

CCCCCCCCc1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.45
TSPO P30536 1/20 0.44
RORA P35398 1/20 0.44
RORC P51449 1/20 0.44
RORB Q92753 1/20 0.44
RARB P10826 8/20 0.42
RARA P10276 2/20 0.42
RARG P13631 1/20 0.42
CTSV O60911 1/20 0.41
CTSL P07711 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
MTOR P42345 1/20 0.41
KMT2A Q03164 1/20 0.41
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40
KAT2B Q92831 1/20 0.40
ICMT O60725 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL25810829 0.94 TSPO (0.45) HSD11B1TSPORORARORCRORB
SCHEMBL24737169 0.94 TSPO (0.44) HSD11B1TSPORORARORCRORB
SCHEMBL25798357 0.93 EP300 (0.44) HSD11B1TSPORORARORCRORB
SCHEMBL25919842 0.93 EP300 (0.44) HSD11B1TSPORORARORCRORB
SCHEMBL24303899 0.92 TSPO (0.43) HSD11B1TSPORORARORCRORB
SCHEMBL25810727 0.89 EP300 (0.45) HSD11B1TSPORORARORCRORB
SCHEMBL24303761 0.88 TSPO (0.44) HSD11B1TSPORORARORCRORB
SCHEMBL16151832 0.88 TSPO (0.42) HSD11B1TSPORORARORCRORB
SCHEMBL24914710 0.87 TSPO (0.43) HSD11B1TSPORORARORCRORB
SCHEMBL9976724 0.87 HSD11B1 (0.48) HSD11B1RORARORCRORBRARB

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-2024150673-A1 MIXED COMPOSITION AND ORGANIC ELECTROLUMINESCENT DEVICE 日鉄ケミカル&マテリアル株式会社 2024-07-18 WO disclosed