SCHEMBL23936831

SCHEMBL23936831

CC1(C)c2ccccc2-c2ccccc2C1(c1ccc(N(c2ccccc2)c2ccc3c(c2)sc2ccccc23)cc1)c1cccc2c1sc1ccccc12

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.32
PARP14 Q460N5 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL23936754 0.94 PARP14 (0.34) ALOX5PARP14
SCHEMBL23936780 0.91 ALOX5 (0.34) ALOX5PARP14
SCHEMBL23936196 0.91 ALDH1A1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936824 0.90 ALOX5 (0.31) ALOX5
SCHEMBL23936821 0.90 ALOX5 (0.31) ALOX5
SCHEMBL23936825 0.89 PRKDC (0.31)
SCHEMBL23936550 0.89 ALDH1A1 (0.32) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23936557 0.86
SCHEMBL23353772 0.80 MAPT (0.35) ALOX5PARP14ALDH1A1MAPTHPGD
SCHEMBL23353768 0.80 PDK2 (0.31) MAPTSMN1; 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