SCHEMBL9466632

SCHEMBL9466632

CCCCCCNC(=O)c1cc(C)ns1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
NAAA Q02083 4/20 0.49
GPR84 Q9NQS5 2/20 0.48
CSNK2A2 P19784 1/20 0.46
KDR P35968 1/20 0.46
CSNK2B P67870 1/20 0.46
CSNK2A1 P68400 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MAOB P27338 1/20 0.44
RAB9A P51151 1/20 0.44
EPHX1 P07099 2/20 0.43
ASAH1 Q13510 1/20 0.43
MLYCD O95822 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL9466326 1.00 L3MBTL1 (0.50) L3MBTL1NAAAGPR84CSNK2A2KDR
SCHEMBL9465963 1.00 L3MBTL1 (0.50) L3MBTL1NAAAGPR84CSNK2A2KDR
SCHEMBL9465369 0.98 L3MBTL1 (0.48) L3MBTL1NAAAGPR84CSNK2A2KDR
SCHEMBL9465987 0.94 CSNK2A2 (0.51) L3MBTL1NAAAGPR84CSNK2A2KDR
SCHEMBL4139704 0.77 EPHX1 (0.50) ALDH1A1EPHX1
SCHEMBL14816297 0.72 NAAA (0.66) L3MBTL1NAAAGPR84ALDH1A1LMNA
SCHEMBL14812810 0.72 NAAA (0.66) L3MBTL1NAAAGPR84ALDH1A1LMNA
SCHEMBL6437809 0.72 NAAA (0.71) L3MBTL1NAAAGPR84ALDH1A1SMN1; SMN2
SCHEMBL9979317 0.72 NAAA (0.71) L3MBTL1NAAAGPR84ALDH1A1SMN1; SMN2
SCHEMBL9979011 0.72 NAAA (0.71) L3MBTL1NAAAGPR84ALDH1A1SMN1; 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-5240951-A Isothiazolecarboxylic acid derivatives, rice blast control agents containing the same as active ingredients, and rice blast control method applying the control agents MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-08-31 US disclosed