SCHEMBL8863253

SCHEMBL8863253

CCN(CC)CC.COc1ccc2c(c1)N(CCCCS(=O)(=O)O)C(=C1SC(=S)N(CCO)C1=O)S2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 14/20 0.62
▸ KMT2A Q03164 14/20 0.62
▸ HSD17B10 Q99714 5/20 0.62
▸ CASP1 P29466 4/20 0.62
▸ ALOX15 P16050 3/20 0.62
▸ ALOX12 P18054 3/20 0.62
▸ HPGD P15428 3/20 0.62
▸ CASP7 P55210 3/20 0.62
▸ LMNA P02545 2/20 0.62
▸ POLB P06746 4/20 0.57
▸ CTDSP1 Q9GZU7 2/20 0.57
▸ RXFP1 Q9HBX9 2/20 0.57
▸ MAPT P10636 7/20 0.55
▸ MMP13 P45452 3/20 0.55
▸ ALDH1A1 P00352 4/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ PKM P14618 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ALPG P10696 1/20 0.43
▸ MAPK1 P28482 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
SCHEMBL8863247 1.00 MEN1 (0.62) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8520497 0.95 MEN1 (0.65) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8863153 0.93 MEN1 (0.58) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8863150 0.93 MEN1 (0.58) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8863180 0.86 KMT2A (0.56) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8863179 0.86 KMT2A (0.56) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8863286 0.85 MEN1 (0.61) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8863282 0.85 MEN1 (0.61) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8863662 0.84 MEN1 (0.86) MEN1KMT2AHSD17B10CASP1ALOX15
SCHEMBL8863661 0.84 MEN1 (0.86) MEN1KMT2AHSD17B10CASP1ALOX15

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-5665887-A Methine compound FUJI PHOTO FILM CO., LTD. (JP) 1997-09-09 — — US disclosed
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