SCHEMBL9517962

SCHEMBL9517962

CCCSc1cn2ccccc2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 14/20 0.48
RAB9A P51151 14/20 0.48
SMN1; SMN2 Q16637 10/20 0.45
ALDH1A1 P00352 5/20 0.45
MAPT P10636 5/20 0.45
PKM P14618 5/20 0.45
KDM4E B2RXH2 4/20 0.45
MAPK1 P28482 3/20 0.45
LMNA P02545 3/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
TP53 P04637 1/20 0.44
SIRT5 Q9NXA8 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL8185284 0.87 NPC1 (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL20053810 0.78 PTGS1 (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL6167210 0.76 PTGS1 (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8189521 0.73 PTGS1 (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL25212725 0.73 KDM4E (0.56) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL9971243 0.71 PDE10A (0.59) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL423547 0.70 NPC1 (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7507665 0.69 PDE10A (0.56) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL1289974 0.68 NPC1 (0.62) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL25027986 0.68 NPC1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT

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
EP-0238070-B1 Sulfonylurea compounds, their production and herbicidal use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-29 EP disclosed
US-5017212-A For rice paddies TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US disclosed
EP-0238070-A2 Sulfonylurea compounds, their production and herbicidal use Takeda Chemical Industries, Ltd. (JP) 1987-09-23 EP disclosed