SCHEMBL25966010

SCHEMBL25966010

CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1nc(-c2ccc(-c3ccccc3)cc2)nc(-n2c3ccccc3c3ccccc32)n1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 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
SCHEMBL15625659 0.98 MEN1 (0.33) GSK3BMEN1ALDH1A1MAPTHPGD
SCHEMBL24216248 0.98 MEN1 (0.33) GSK3BMEN1ALDH1A1MAPTHPGD
SCHEMBL2603576 0.98 ABCG2 (0.30)
SCHEMBL24078161 0.96 GSK3B (0.31) GSK3BMEN1ALDH1A1MAPTHPGD
SCHEMBL31853 0.95 L3MBTL1 (0.32) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL19104487 0.95 MEN1 (0.33) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL25965944 0.94 CAMK2D (0.32) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL25966007 0.94 ATM (0.34) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL19104483 0.94
SCHEMBL15625658 0.94 MEN1 (0.34) MEN1ALDH1A1MAPTHPGDKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed