SCHEMBL23936826

SCHEMBL23936826

CC1(C)c2ccccc2-c2ccccc2C1(c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)c1cccc2c1sc1ccccc12

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.37
PARP14 Q460N5 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
MAPT P10636 1/20 0.32
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
F9 P00740 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
SCHEMBL23936840 0.92 MEN1 (0.42) ALOX5MEN1KMT2AATMMAPT
SCHEMBL23936757 0.89 TDP1 (0.36) ALOX5PARP14MEN1KMT2AATM
SCHEMBL23936754 0.82 PARP14 (0.34) ALOX5PARP14
SCHEMBL23936780 0.81 ALOX5 (0.34) ALOX5PARP14
SCHEMBL23936074 0.80 L3MBTL1 (0.41) MEN1KMT2AATMMAPTL3MBTL1
SCHEMBL23936666 0.77 TSHR (0.32) KMT2AATMMAPTL3MBTL1
SCHEMBL18053424 0.77 ALOX5 (0.38) ALOX5PARP14TNKSTNKS2
SCHEMBL15501946 0.76 ALOX5 (0.42) ALOX5PARP14MEN1KMT2AATM
SCHEMBL15501790 0.76 ALOX5 (0.56) ALOX5PARP14MEN1KMT2AATM
SCHEMBL15501883 0.76 ALOX5 (0.56) ALOX5PARP14MEN1KMT2AATM

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