SCHEMBL9651283

SCHEMBL9651283

CN1C(=C2SC(=S)N(CCS(=O)(=O)O)C2=O)Sc2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 14/20 0.67
▸ KMT2A Q03164 14/20 0.67
▸ POLB P06746 10/20 0.67
▸ MAPT P10636 5/20 0.67
▸ MMP13 P45452 4/20 0.67
▸ HPGD P15428 4/20 0.62
▸ ALOX15 P16050 3/20 0.62
▸ ALOX12 P18054 3/20 0.62
▸ CASP1 P29466 3/20 0.62
▸ HSD17B10 Q99714 3/20 0.62
▸ CASP7 P55210 2/20 0.62
▸ LMNA P02545 1/20 0.62
▸ CTDSP1 Q9GZU7 4/20 0.57
▸ ALDH1A1 P00352 4/20 0.57
▸ L3MBTL1 Q9Y468 2/20 0.57
▸ RXFP1 Q9HBX9 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ TDP1 Q9NUW8 6/20 0.48
▸ ALPG P10696 2/20 0.48
▸ MAPK1 P28482 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
SCHEMBL9651276 1.00 MEN1 (0.67) MEN1KMT2APOLBMAPTMMP13
SCHEMBL11207327 0.89 MEN1 (0.81) MEN1KMT2APOLBMAPTMMP13
SCHEMBL6264761 0.89 MEN1 (0.81) MEN1KMT2APOLBMAPTMMP13
SCHEMBL10713249 0.88 MEN1 (0.79) MEN1KMT2APOLBMAPTMMP13
SCHEMBL17069352 0.86 KMT2A (0.62) MEN1KMT2APOLBMAPTMMP13
SCHEMBL2333246 0.83 MEN1 (0.81) MEN1KMT2APOLBMAPTMMP13
SCHEMBL15995453 0.83 MEN1 (0.81) MEN1KMT2APOLBMAPTMMP13
SCHEMBL2333243 0.83 MEN1 (0.81) MEN1KMT2APOLBMAPTMMP13
SCHEMBL9054686 0.83 MEN1 (0.60) MEN1KMT2APOLBMAPTMMP13
SCHEMBL9054683 0.83 MEN1 (0.60) MEN1KMT2APOLBMAPTMMP13

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
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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