SCHEMBL23936402

SCHEMBL23936402

CC1(C)c2ccccc2-c2cc(-c3nc4ccccc4nc3-c3ccc4c(c3)sc3ccccc34)ccc2C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
MAPT P10636 3/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 4/20 0.33
POLB P06746 2/20 0.33
GPR3 P46089 1/20 0.33
KMT2A Q03164 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
APP P05067 1/20 0.32
ALOX5 P09917 1/20 0.32
AKT1 P31749 1/20 0.32
AKT2 P31751 1/20 0.32
KDM4E B2RXH2 2/20 0.31
LMNA P02545 2/20 0.31
GAA P10253 1/20 0.31
ATM Q13315 1/20 0.31
TLR9 Q9NR96 1/20 0.31
THRB P10828 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
SCHEMBL23936310 0.93 ALDH1A1 (0.35) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936493 0.92 L3MBTL1 (0.37) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936410 0.90 ALDH1A1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23935982 0.89 F9 (0.35) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936213 0.88 L3MBTL1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936281 0.88 ALDH1A1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23935986 0.86 ALDH1A1 (0.36) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936752 0.85 L3MBTL1 (0.37) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL15040965 0.82 ALDH1A1 (0.49) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936382 0.81 TDP1 (0.50) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2

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
US-20210328150-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 US disclosed