SCHEMBL23759882

SCHEMBL23759882

Bc1cccc(CCCCCCc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 10/20 0.50
▸ IGF1R P08069 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ MAOA P21397 2/20 0.48
▸ MAPT P10636 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ MAOB P27338 3/20 0.47
▸ HDAC1 Q13547 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL14402554 0.82 LPL (0.56) L3MBTL1
SCHEMBL27914585 0.80 MAPT (0.62) MAPTRXFP1HDAC1
SCHEMBL21292119 0.79 LPL (0.49) L3MBTL1
SCHEMBL8086519 0.79 SIGMAR1 (0.71) SIGMAR1MAOAMAPTRXFP1MAOB
SCHEMBL8860760 0.79 SIGMAR1 (0.71) SIGMAR1MAOAMAPTRXFP1MAOB
SCHEMBL8096690 0.79 SIGMAR1 (0.71) SIGMAR1MAOAMAPTRXFP1MAOB
SCHEMBL347066 0.79 SIGMAR1 (0.71) SIGMAR1MAOAMAPTRXFP1MAOB
SCHEMBL2822511 0.79 SIGMAR1 (0.71) SIGMAR1MAOAMAPTRXFP1MAOB
SCHEMBL8100057 0.79 SIGMAR1 (0.71) SIGMAR1MAOAMAPTRXFP1MAOB
SCHEMBL8099665 0.79 SIGMAR1 (0.71) SIGMAR1MAOAMAPTRXFP1MAOB

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-2021161974-A1 IRIDIUM COMPLEX COMPOUND, IRIDIUM COMPLEX COMPOUND-CONTAINING COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT AND PRODUCTION METHOD THEREFOR, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING DEVICE 三菱ケミカル株式会社 2021-08-19 — — WO disclosed
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