SCHEMBL9537123

SCHEMBL9537123

COc1ccc(N)c(N)c1Cc1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
IDO1 P14902 1/20 0.44
MBOAT4 Q96T53 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
EP300 Q09472 1/20 0.42
KAT8 Q9H7Z6 1/20 0.42
SYK P43405 7/20 0.42
ALOX15 P16050 1/20 0.41
AURKB Q96GD4 1/20 0.41
INCENP Q9NQS7 1/20 0.41
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
CHRNA7 P36544 2/20 0.39

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
SCHEMBL8888497 0.79 SMN1; SMN2 (0.48) SMN1; SMN2L3MBTL1SYKALOX15AURKB
SCHEMBL6475571 0.76 IDO1 (0.46) SMN1; SMN2IDO1EP300KAT8KDM4E
SCHEMBL2750449 0.71 KDM4E (0.56) SMN1; SMN2IDO1L3MBTL1SYKAURKB
SCHEMBL28306283 0.71 ALOX15 (0.64) SMN1; SMN2L3MBTL1ALOX15KDM4E
SCHEMBL29181814 0.70 IDO1 (0.44) SMN1; SMN2IDO1L3MBTL1EP300KAT8
SCHEMBL23837621 0.70 L3MBTL1 (0.42) SMN1; SMN2L3MBTL1SYKAURKBINCENP
SCHEMBL9379876 0.70 ALOX15 (0.55) SMN1; SMN2L3MBTL1ALOX15KDM4E
SCHEMBL9539903 0.70 L3MBTL1 (0.42) SMN1; SMN2L3MBTL1SYKAURKBINCENP
SCHEMBL7076400 0.69 IDO1 (0.40) SMN1; SMN2IDO1EP300KAT8
SCHEMBL9536141 0.69 LMNA (0.39) SMN1; SMN2IDO1EP300KAT8KDM4E

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
EP-0151826-B1 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines JANSSEN PHARMACEUTICA N.V. (BE) 1993-03-31 EP disclosed
EP-0151826-A1 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines JANSSEN PHARMACEUTICA N.V. (BE) 1985-08-21 EP disclosed