SCHEMBL8056906

SCHEMBL8056906

O=S(=O)(Nc1nc(-c2ccccc2)c(-c2ccccc2)s1)c1ccc(Cl)cc1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.76
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
LMNA P02545 1/20 0.62
ALOX12 P18054 1/20 0.62
HTT P42858 1/20 0.62
PTPN1 P18031 5/20 0.56
CDC25B P30305 5/20 0.56
DUSP3 P51452 5/20 0.56
MYC P01106 1/20 0.52
WDR5 P61964 1/20 0.52
PTGS2 P35354 3/20 0.48
PTGS1 P23219 2/20 0.48

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
SCHEMBL4110122 0.90 KDM1A (0.76) KDM1AMEN1KMT2ALMNAPTPN1
SCHEMBL8056880 0.84 PTPN1 (0.67) KDM1AMEN1KMT2APTPN1CDC25B
SCHEMBL25351420 0.82 KMT2A (0.67) KDM1AMEN1KMT2ALMNAPTPN1
SCHEMBL9615924 0.81 KDM1A (0.58) KDM1AMEN1KMT2APTPN1CDC25B
SCHEMBL25352951 0.80 KMT2A (0.65) KDM1AMEN1KMT2ALMNAALOX12
SCHEMBL18230287 0.79 KDM1A (0.50) KDM1AMEN1KMT2ALMNAALOX12
SCHEMBL2762656 0.79 DHODH (0.71) MEN1KMT2ALMNAHTT
SCHEMBL4115163 0.77 HSD17B10 (0.68) KDM1AMEN1KMT2APTPN1CDC25B
SCHEMBL8056872 0.77 KDM1A (0.58) KDM1AMEN1KMT2APTPN1CDC25B
SCHEMBL2781852 0.76 KMT2A (0.70) KDM1AMEN1KMT2ALMNAALOX12

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
EP-0592664-B1 DERIVATIVES OF DIPHENYLTHIAZOLE WITH ANTIINFLAMMATORY ACTIVITY HISAMITSU PHARMACEUTICAL CO (JP) 2000-07-05 EP claimed
EP-0592664-B1 DERIVATIVES OF DIPHENYLTHIAZOLE WITH ANTIINFLAMMATORY ACTIVITY HISAMITSU PHARMACEUTICAL CO (JP) 2000-07-05 EP disclosed