SCHEMBL11319484

SCHEMBL11319484

CCS(=O)(=O)c1nsc(N)n1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
GAA P10253 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31

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
SCHEMBL3902158 0.78 MAPT (0.38) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL11330016 0.73 MAPT (0.35) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL11328859 0.73 CYP2D6 (0.48) ALDH1A1LMNAHPGDMAPTHTT
SCHEMBL8960580 0.69 PSIP1 (0.38) MAPTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL91381 0.64
SCHEMBL2645321 0.61 SMN1; SMN2 (0.43) ALDH1A1LMNAMAPTHTTHSD17B10
SCHEMBL4939076 0.61
SCHEMBL11331844 0.60
SCHEMBL3906072 0.60
SCHEMBL9860007 0.60 CA2 (0.59) ALDH1A1HTTHSD17B10SMN1; SMN2GAA

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-4259236-A COLORFAST RED SHADES ON POLYESTERS CIBA-GEIGY CORPORATION (US) 1981-03-31 US disclosed