SCHEMBL11340441

SCHEMBL11340441

CN(C)c1csc(-c2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.40
HSD17B1 P14061 4/20 0.39
HSD17B2 P37059 4/20 0.39
DYRK1A Q13627 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAPK1 P28482 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
NPY1R P25929 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL21723992 0.76 HSD17B1 (0.41) HSD17B1HSD17B2MAPTLMNACNR1
SCHEMBL72613 0.72 AR (0.43) ARHSD17B1HSD17B2DYRK1ADYRK1B
SCHEMBL2157908 0.72 HSD17B1 (0.44) HSD17B1HSD17B2SMN1; SMN2NPC1MAPK1
SCHEMBL7915311 0.72 HSD17B1 (0.61) ARHSD17B1HSD17B2DYRK1ADYRK1B
SCHEMBL23452123 0.71 ALDH1A1 (0.49) HSD17B1HSD17B2MAPTSMN1; SMN2NPC1
SCHEMBL1252082 0.70 ALDH1A1 (0.52) MAPTSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL3907230 0.70 AR (0.44) ARHSD17B1HSD17B2DYRK1ADYRK1B
SCHEMBL23452018 0.69 MAPT (0.50) MAPTSMN1; SMN2NPC1RAB9AMAPK1
SCHEMBL11229774 0.68 MAPT (0.31) DYRK1ADYRK1BMAPTSMN1; SMN2
SCHEMBL4947340 0.68 CNR1 (0.50) ARHSD17B1HSD17B2DYRK1ADYRK1B

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-20200208285-A1 ELECTROLYTIC SN OR SN ALLOY PLATING SOLUTION AND METHOD FOR PRODUCING SN OR SN ALLOY PLATED ARTICLE UEMURA KOGYO KK (JP) 2020-07-02 US disclosed
US-4246267-A HYPOTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1981-01-20 US disclosed