SCHEMBL9827239

SCHEMBL9827239

CCCS(=O)(=O)c1nc(Cl)c(C#N)s1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 2/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
RXFP1 Q9HBX9 2/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL9827086 0.91 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2NPC1MEN1KMT2A
SCHEMBL9827817 0.89 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2NPC1MEN1KMT2A
SCHEMBL9826317 0.81 LOXL2 (0.35) ALDH1A1MEN1KMT2ARXFP1LOXL2
SCHEMBL9827563 0.73 KDM4E (0.38) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL10569137 0.71 CCR4 (0.34) SMN1; SMN2POLB
SCHEMBL9826175 0.71 KDM4E (0.34) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL11388959 0.69 LOXL2 (0.34) ALDH1A1KMT2ALOXL2POLB
SCHEMBL9826021 0.69 KDM4E (0.33) ALDH1A1SMN1; SMN2RXFP1
SCHEMBL10566914 0.68 KMT2A (0.40) ALDH1A1SMN1; SMN2MEN1KMT2ARXFP1
SCHEMBL9826549 0.67 MAPK8 (0.34) ALDH1A1SMN1; SMN2NPC1MEN1KMT2A

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-0301613-B1 THIAZOLE COMPOUNDS HAVING FUNGICIDAL ACTIVITY DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1991-07-10 EP disclosed
US-4889863-A NONPHYTOTOXIC; SEEDS, SOILS DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1989-12-26 US disclosed
EP-0301613-A1 Thiazole compounds having fungicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1989-02-01 EP disclosed