SCHEMBL9718865

SCHEMBL9718865

Nc1ccccc1-c1nc2c(-c3ccccc3N)cccc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
ALDH1A1 P00352 3/20 0.65
NPC1 O15118 3/20 0.65
RAB9A P51151 3/20 0.65
HPGD P15428 2/20 0.65
KDM4E B2RXH2 2/20 0.65
MAPT P10636 2/20 0.65
GLA P06280 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
HSD17B10 Q99714 1/20 0.65
DHODH Q02127 1/20 0.50
MGAM O43451 5/20 0.49
SI P14410 5/20 0.49
MGAM2 Q2M2H8 5/20 0.49
PARP1 P09874 5/20 0.47
NUDT1 P36639 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
DCUN1D1 Q96GG9 1/20 0.45
CDK1 P06493 1/20 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
SCHEMBL9045167 0.82 PARP1 (0.60) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL7717958 0.82 GAA (0.55) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL218892 0.79 NPC1 (1.00) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL29424535 0.79 NPC1 (1.00) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL7717951 0.77 GAA (0.50) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL913494 0.77 PDE5A (0.68) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL8900530 0.76 GAA (0.74) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL4563722 0.75 PARP1 (0.67) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL28252744 0.75 NPC1 (0.55) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL5565092 0.74 PARP1 (0.60) GAASMN1; SMN2ALDH1A1NPC1RAB9A

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-5151472-A Dissolving polyetherimides in a solvent, adding a dianhydride and a diamine, reacting to form a polyamic acid and cyclizing to form a polyimide GENERAL DYNAMICS CORPORATION, CONVAIR DIVISION (US) 1992-09-29 US disclosed