SCHEMBL9054819

SCHEMBL9054819

COc1ccc2c(c1)N(C)C(=C1SC(=S)N(CC(=O)O)C1=O)S2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 12/20 0.66
▸ MEN1 O00255 11/20 0.66
▸ MAPT P10636 3/20 0.55
▸ ALDH1A1 P00352 2/20 0.53
▸ RXFP1 Q9HBX9 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ CASP1 P29466 1/20 0.53
▸ CASP7 P55210 1/20 0.53
▸ ESR2 Q92731 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ AKR1B1 P15121 1/20 0.50
▸ PTGES O14684 1/20 0.45
▸ APEX1 P27695 1/20 0.45
▸ TAS2R14 Q9NYV8 1/20 0.43
▸ PTPN7 P35236 1/20 0.43
▸ CACNA1B Q00975 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
SCHEMBL9054817 1.00 KMT2A (0.66) KMT2AMEN1MAPTALDH1A1RXFP1
SCHEMBL9651314 0.85 MEN1 (0.64) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL9055820 0.85 MEN1 (0.64) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL8863145 0.84 MEN1 (0.61) KMT2AMEN1MAPTALDH1A1RXFP1
SCHEMBL8863144 0.84 MEN1 (0.61) KMT2AMEN1MAPTALDH1A1RXFP1
SCHEMBL8863282 0.83 MEN1 (0.61) KMT2AMEN1MAPTALDH1A1RXFP1
SCHEMBL8863286 0.83 MEN1 (0.61) KMT2AMEN1MAPTALDH1A1RXFP1
SCHEMBL9651111 0.82 MEN1 (0.46) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL9053529 0.82 MEN1 (0.46) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL8606927 0.82 MEN1 (0.61) KMT2AMEN1MAPTALDH1A1LMNA

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-0487010-B1 Improved sensitization of tabular grains with a zeromethine dye and a tetraazaindene DU PONT (US) 1996-03-20 — — EP claimed
EP-0487010-A1 Improved sensitization of tabular grains with a zeromethine dye and a tetraazaindene E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-05-27 — — EP claimed
EP-0487010-A1 Improved sensitization of tabular grains with a zeromethine dye and a tetraazaindene E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-05-27 — — EP disclosed
US-5108887-A Zeromethine merocyanine dyes as J-aggregating spectral sensitizers for tabular emulsions E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-28 — — US disclosed
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