SCHEMBL8770476

SCHEMBL8770476

CC(Sc1nnc(S)s1)Sc1nnc(S)s1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 1/20 0.33
ALOX15 P16050 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
PTGS1 P23219 1/20 0.30

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
SCHEMBL11617926 0.86 NPC1 (0.43) ALDH1A1HPGDHSD17B10NPC1ALOX15
SCHEMBL2329960 0.83 ALDH1A1 (0.39) ALDH1A1NPC1ALOX15RAB9ASMN1; SMN2
SCHEMBL20681834 0.79 NPC1 (0.39) ALDH1A1NPC1ALOX15RAB9ASMN1; SMN2
SCHEMBL2117230 0.79 ALDH1A1 (0.41) ALDH1A1
SCHEMBL9664281 0.77
SCHEMBL16168916 0.77 ALDH1A1 (0.50) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL19387255 0.77 FBP1 (0.36) ALDH1A1
SCHEMBL1959315 0.77 ALDH1A1 (0.50) ALDH1A1HSD17B10SMN1; SMN2
SCHEMBL1030635 0.73
SCHEMBL7676528 0.73 ALDH1A1 (0.78) ALDH1A1HPGDSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150287953-A1 TRANSPARENT ELECTRODE, ELECTRONIC DEVICE, AND ORGANIC ELECTROLUMINESCENT ELEMENT Konica Minolta, Inc. (JP) 2015-10-08 US disclosed
EP-0796890-A1 Vulcanizable acrylic rubber composition ENICHEM S.p.A. (IT) 1997-09-24 EP disclosed
US-4128510-A 2,5-DIMERCAPTO-1,3,4-THIADIAZOLES HERCULES INCORPORATED (US) 1978-12-05 US disclosed