SCHEMBL23936196

SCHEMBL23936196

CC1(C)c2ccccc2-c2ccccc2C1(c1ccccc1)c1ccc(N(c2ccccc2)c2ccc3c(c2)sc2ccccc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GPR3 P46089 1/20 0.31
POLB P06746 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL23936550 0.96 ALDH1A1 (0.32) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936831 0.91 ALOX5 (0.32) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936557 0.86
SCHEMBL17805040 0.83 MAPT (0.39) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936754 0.83 PARP14 (0.34)
SCHEMBL23935987 0.83 ALDH1A1 (0.36) ALDH1A1MAPTSMN1; SMN2TDP1L3MBTL1
SCHEMBL23936481 0.82 ALDH1A1 (0.37) ALDH1A1MAPTSMN1; SMN2TDP1L3MBTL1
SCHEMBL17805008 0.81 MAPT (0.36) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL26574310 0.81 F9 (0.34) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL19735520 0.80 MAPT (0.34) 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