SCHEMBL10464650

SCHEMBL10464650

OCc1csc(NCc2ccccc2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 8/20 0.53
ALDH1A1 P00352 9/20 0.51
LMNA P02545 4/20 0.50
HPGD P15428 4/20 0.50
NPSR1 Q6W5P4 3/20 0.50
HTT P42858 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HSD17B10 Q99714 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 7/20 0.49
GAA P10253 5/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
RAB9A P51151 2/20 0.49
PKM P14618 1/20 0.49
KDM4E B2RXH2 4/20 0.49
TDP1 Q9NUW8 3/20 0.47
NPC1 O15118 1/20 0.46
MAPK1 P28482 2/20 0.45
ROCK2 O75116 1/20 0.45

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
SCHEMBL29194745 0.84 ALDH1A1 (0.51) SCDALDH1A1LMNAHPGDNPSR1
SCHEMBL7016372 0.83 SCD (0.61) SCDALDH1A1LMNAMAPTGAA
SCHEMBL20392523 0.79 RAB9A (0.59) SCDALDH1A1LMNAHPGDHTT
SCHEMBL18398876 0.77 ALDH1A1 (0.58) ALDH1A1LMNAHPGDNPSR1HTT
SCHEMBL10464778 0.77 GAA (0.57) ALDH1A1LMNANPSR1SMN1; SMN2HSD17B10
SCHEMBL10591917 0.77 RAB9A (0.76) SCDALDH1A1LMNAHPGDNPSR1
SCHEMBL525660 0.76 ALDH1A1 (0.54) SCDALDH1A1LMNAHPGDNPSR1
SCHEMBL1820346 0.75 ALDH1A1 (0.76) ALDH1A1LMNAHPGDNPSR1HTT
SCHEMBL10464271 0.74 KMT2A (0.46) SCDALDH1A1LMNAHPGDNPSR1
SCHEMBL13256497 0.74 LMNA (0.48) SCDALDH1A1LMNAHPGDNPSR1

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-4933355-A ALDOSE REDUCTASE INHIBITORS SANKYO COMPANY LIMITED (JP) 1990-06-12 US disclosed
EP-0337819-A1 Thiazole derivatives, their preparation and their use in the treatment of diabetes complications Sankyo Company Limited (JP) 1989-10-18 EP disclosed