SCHEMBL11447993

SCHEMBL11447993

CSC1=Nc2c(Cl)cccc2SC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B3 P37058 1/20 0.33
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL7458656 0.73 OPRK1 (0.37) SMN1; SMN2NPC1RAB9A
SCHEMBL7458637 0.68 RPS6KA3 (0.37) HPGDSMN1; SMN2HSD17B3
SCHEMBL7457955 0.68 MAPT (0.39) HPGDSMN1; SMN2HSD17B3
SCHEMBL28294007 0.67 MAPT (0.34) HPGDSMN1; SMN2
SCHEMBL9635032 0.62 HTT (0.42) NPC1RAB9A
SCHEMBL11448289 0.61 CCNB2 (0.37) HSD17B3
SCHEMBL11448549 0.61 AURKA (0.39) HSD17B3
SCHEMBL8526930 0.58 HTR5A (0.40) HSD17B3
SCHEMBL9512603 0.57 HPGD (0.34) HPGD
SCHEMBL5594805 0.57 CYP1A2 (0.43) HPGDSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4223136-A 2,3-Dihydro-3-oxo-5H-pyrido[3,4-b][1,4]-benzothiazine-4-carbonitriles G. D. SEARLE & CO. (US) 1980-09-16 US disclosed