SCHEMBL29330640

SCHEMBL29330640

COc1ccc(Nc2ccc(C)cc2)cc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.53
GAA P10253 2/20 0.53
MEN1 O00255 1/20 0.53
G6PD P11413 1/20 0.53
KMT2A Q03164 1/20 0.53
RAPGEF4 Q8WZA2 1/20 0.47
ACHE P22303 1/20 0.47
HPGD P15428 1/20 0.47
AGPAT2 O15120 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
THRB P10828 1/20 0.43
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 2/20 0.43

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
SCHEMBL16620674 0.92 MAPT (0.46) L3MBTL1GAAMEN1G6PDKMT2A
SCHEMBL15497460 0.87 MAPT (0.63) L3MBTL1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL16621247 0.87 MEN1 (0.51) L3MBTL1GAAMEN1KMT2AHPGD
SCHEMBL10995371 0.80 MAPT (0.50) GAAMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL13955886 0.79 NPC1 (0.58) L3MBTL1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL9290196 0.78 MAPT (0.45) GAAMEN1KMT2AACHESMN1; SMN2
SCHEMBL7763499 0.77 GAA (0.63) L3MBTL1GAAMEN1G6PDKMT2A
SCHEMBL144308 0.77 ACHE (0.68) L3MBTL1GAAMEN1KMT2AACHE
SCHEMBL29352952 0.77 ACHE (0.68) L3MBTL1GAAMEN1KMT2AACHE
SCHEMBL13532211 0.76 ALDH1A1 (0.44) GAAMEN1KMT2AACHESMN1; 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
WO-2024147313-A1 HOLE TRANSPORTING MATERIAL 日本精化株式会社 2024-07-11 WO disclosed