SCHEMBL17574085

SCHEMBL17574085

c1ccc(-c2nnc(-c3cccc(-c4nnc(-c5ccccc5)[nH]4)c3)[nH]2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.53
NPC1 O15118 4/20 0.53
POLB P06746 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SCN2A Q99250 3/20 0.43
NPY5R Q15761 1/20 0.43
BTK Q06187 1/20 0.43
GP6 Q9HCN6 1/20 0.42
GAA P10253 5/20 0.42
MAPT P10636 3/20 0.41
MAPK1 P28482 2/20 0.40
MTOR P42345 1/20 0.40
ADK P55263 1/20 0.40
NISCH Q9Y2I1 1/20 0.40
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL384952 0.90 NPC1 (0.61) RAB9ANPC1POLBL3MBTL1SCN2A
SCHEMBL24317555 0.87 NPC1 (0.59) RAB9ANPC1POLBL3MBTL1SCN2A
SCHEMBL17948203 0.85 NPC1 (0.57) RAB9ANPC1POLBL3MBTL1SCN2A
Naphthalene SCHEMBL28228080 0.83 NPC1 (0.55) RAB9ANPC1POLBL3MBTL1SCN2A
SCHEMBL1500015 0.81 ADORA2A (0.47) RAB9ANPC1POLBL3MBTL1NISCH
SCHEMBL15058469 0.77 NPC1 (0.50) RAB9ANPC1POLBL3MBTL1SCN2A
SCHEMBL16661157 0.77 ALDH1A1 (0.58) RAB9ANPC1POLBL3MBTL1SCN2A
SCHEMBL21067971 0.77 NPC1 (0.52) RAB9ANPC1POLBL3MBTL1SCN2A
SCHEMBL12716533 0.77 NPC1 (0.37) RAB9ANPC1POLBL3MBTL1SCN2A
SCHEMBL8819870 0.76 NPC1 (0.48) RAB9ANPC1POLBL3MBTL1SCN2A

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-9720140-B2 Optical film, circularly polarizing plate and organic electroluminescent display device Konica Minolta, Inc. (JP) 2017-08-01 US disclosed
US-20160070030-A1 OPTICAL FILM, CIRCULARLY POLARIZING PLATE AND ORGANIC ELECTROLUMINESCENT DISPLAY DEVICE Konica Minolta, Inc. (JP) 2016-03-10 US disclosed