SCHEMBL9651111

SCHEMBL9651111

CN1C(=C2SC(=S)N(CC(=O)O)C2=O)Sc2ccc(C(F)(F)F)cc21

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 10/20 0.46
▸ KMT2A Q03164 10/20 0.46
▸ APEX1 P27695 2/20 0.44
▸ PTGES O14684 1/20 0.44
▸ FPR2 P25090 1/20 0.44
▸ HPGD P15428 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ RAD52 P43351 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.40

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
SCHEMBL9053529 1.00 MEN1 (0.46) MEN1KMT2AAPEX1PTGESFPR2
SCHEMBL9651314 0.84 MEN1 (0.64) MEN1KMT2AAPEX1PTGESKDM4E
SCHEMBL9055820 0.84 MEN1 (0.64) MEN1KMT2AAPEX1PTGESKDM4E
SCHEMBL9054817 0.82 KMT2A (0.66) MEN1KMT2AAPEX1PTGESNPSR1
SCHEMBL9054819 0.82 KMT2A (0.66) MEN1KMT2AAPEX1PTGESNPSR1
SCHEMBL8606927 0.82 MEN1 (0.61) MEN1KMT2AAPEX1PTGESHPGD
SCHEMBL8606929 0.82 MEN1 (0.61) MEN1KMT2AAPEX1PTGESHPGD
SCHEMBL9651470 0.76 MEN1 (0.58) MEN1KMT2AAPEX1PTGESHPGD
SCHEMBL9651467 0.76 MEN1 (0.58) MEN1KMT2AAPEX1PTGESHPGD
SCHEMBL12990663 0.74 KMT2A (0.49) MEN1KMT2AALDH1A1LMNAMAPT

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-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
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 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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