SCHEMBL19307752

SCHEMBL19307752

Nc1ccc2c(c1)Cc1ccc(N)cc1-2.Nc1cccc(N)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.71
ALDH1A1 P00352 5/20 0.71
LMNA P02545 4/20 0.71
NPC1 O15118 4/20 0.71
SMN1; SMN2 Q16637 4/20 0.71
MAPT P10636 3/20 0.71
HPGD P15428 3/20 0.71
KDM4E B2RXH2 2/20 0.71
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
TLR9 Q9NR96 1/20 0.50
CASP1 P29466 2/20 0.48
CYP3A4 P08684 2/20 0.48
RECQL P46063 1/20 0.48
GAA P10253 1/20 0.43
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PARP1 P09874 2/20 0.41
TDP2 O95551 2/20 0.41
TDP1 Q9NUW8 3/20 0.40

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
SCHEMBL65503 0.92 RAB9A (0.76) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL29724705 0.92 RAB9A (0.76) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL2522633 0.85 MAPT (0.64) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL123584 0.85 RAB9A (0.78) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL29372630 0.85 RAB9A (0.78) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL23989284 0.83 RAB9A (1.00) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL2362632 0.83 RAB9A (0.84) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL225901 0.83 RAB9A (1.00) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL29556700 0.83 RAB9A (1.00) RAB9AALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL30497775 0.83 RAB9A (0.84) RAB9AALDH1A1LMNANPC1SMN1; 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
US-20170255100-A1 DRY FILM STRUCTURE FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2017-09-07 US disclosed