SCHEMBL7016372

SCHEMBL7016372

O=C(O)Cc1csc(NCc2ccccc2)n1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCD O00767 10/20 0.61
ALDH1A1 P00352 4/20 0.59
GAA P10253 4/20 0.53
MAPT P10636 4/20 0.53
RAB9A P51151 2/20 0.52
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.52
PKM P14618 1/20 0.52
KMT2A Q03164 1/20 0.52
NPC1 O15118 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
MME P08473 1/20 0.49
PTGDR2 Q9Y5Y4 1/20 0.49

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
SCHEMBL20392523 0.86 RAB9A (0.59) SCDALDH1A1GAAMAPTRAB9A
SCHEMBL7454854 0.83 ROCK2 (0.62) SCDALDH1A1LMNAMME
SCHEMBL10464650 0.83 SCD (0.53) SCDALDH1A1GAAMAPTRAB9A
SCHEMBL27743104 0.81 ALDH1A1 (0.58) SCDALDH1A1MEN1KMT2AMME
SCHEMBL29194745 0.80 ALDH1A1 (0.51) SCDALDH1A1GAAMAPTRAB9A
SCHEMBL525660 0.79 ALDH1A1 (0.54) SCDALDH1A1GAAMAPTRAB9A
SCHEMBL10067956 0.78 GAA (0.55) SCDALDH1A1GAAMAPTRAB9A
SCHEMBL7018310 0.78 MEN1 (0.55) SCDALDH1A1GAAMAPTRAB9A
SCHEMBL4832627 0.77 ALDH1A1 (0.59) SCDALDH1A1RAB9ALMNANPC1
SCHEMBL14675710 0.77 GAA (0.51) SCDALDH1A1GAAMAPTRAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0972769-B1 NOVEL AMIDE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF YAMANOUCHI PHARMA CO LTD (JP) 2003-04-16 EP disclosed
US-6177454-B1 ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2001-01-23 US disclosed
US-6048884-A ANTIDIABETIC AGENTS; HYPOGLYCEMIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2000-04-11 US disclosed
EP-0972769-A1 NOVEL AMIDE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2000-01-19 EP disclosed