SCHEMBL4966463

SCHEMBL4966463

Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)nc(C)n3C)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.64
KDM4E B2RXH2 4/20 0.61
APOBEC3A P31941 1/20 0.61
APOBEC3G Q9HC16 1/20 0.61
RAB9A P51151 3/20 0.61
NPC1 O15118 2/20 0.61
ALDH1A1 P00352 4/20 0.58
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
TAS2R14 Q9NYV8 1/20 0.57
HTT P42858 2/20 0.55
GAA P10253 2/20 0.55
ALOX12 P18054 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
LMNA P02545 2/20 0.53
MAPT P10636 2/20 0.53
XBP1 P17861 1/20 0.53
HPGD P15428 1/20 0.52
PTPN2 P17706 1/20 0.52
PTPN1 P18031 1/20 0.52

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
SCHEMBL617311 0.88 SMN1; SMN2 (0.56) PAX8RAB9ANPC1ALDH1A1TAS2R14
SCHEMBL617343 0.86 NR1I2 (0.58) PAX8KDM4EAPOBEC3AAPOBEC3GRAB9A
SCHEMBL616092 0.78 NPC1 (0.55) PAX8KDM4ERAB9ANPC1ALDH1A1
SCHEMBL5704502 0.77 ALDH1A1 (0.64) KDM4EALDH1A1KMT2AMEN1HTT
SCHEMBL618857 0.77 LMNA (0.50) KDM4ERAB9ANPC1HTTSMN1; SMN2
SCHEMBL618899 0.77 NPC1 (0.54) PAX8KDM4ERAB9ANPC1ALDH1A1
SCHEMBL13106657 0.76 ALDH1A1 (0.53) PAX8KDM4EAPOBEC3AAPOBEC3GALDH1A1
SCHEMBL17560722 0.76 BRPF1 (0.79) KMT2A
SCHEMBL616054 0.76 NPC1 (0.53) KDM4ERAB9ANPC1KMT2AMEN1
SCHEMBL4589934 0.75 PTPN2 (0.57) PAX8KDM4EAPOBEC3AAPOBEC3GALDH1A1

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
EP-1670790-B1 BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2008-08-20 EP claimed