SCHEMBL8622093

SCHEMBL8622093

CCC=C(OCC)c1sc2ccc(Cl)cc2[n+]1CCCCS(=O)(=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
HPGD P15428 6/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
THRB P10828 2/20 0.45
RECQL P46063 2/20 0.45
ALDH1A1 P00352 6/20 0.39
POLB P06746 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
PKM P14618 1/20 0.37
OPRK1 P41145 1/20 0.37
BLM P54132 1/20 0.37
KDM4E B2RXH2 4/20 0.34
GAA P10253 3/20 0.33
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL7736647 0.79 MEN1 (0.74) MAPTHPGDMEN1KMT2ATHRB
SCHEMBL8517706 0.75 MAPT (0.77) MAPTHPGDMEN1KMT2ATHRB
SCHEMBL2929704 0.70 MAPT (0.64) MAPTHPGDMEN1KMT2ATHRB
SCHEMBL8942584 0.69 HPGD (0.90) MAPTHPGDMEN1KMT2ATHRB
SCHEMBL7737349 0.68 MEN1 (0.74) MAPTHPGDMEN1KMT2ATHRB
SCHEMBL4166184 0.67 KDM4E (0.70) MAPTHPGDMEN1KMT2ATHRB
SCHEMBL9226505 0.66 MAPT (0.62) MAPTHPGDMEN1KMT2ATHRB
SCHEMBL29395167 0.66 MAPT (0.62) MAPTHPGDMEN1KMT2ATHRB
Water SCHEMBL10600149 0.65 MAPT (0.61) MAPTHPGDMEN1KMT2ATHRB
SCHEMBL12201238 0.65 KDM4E (0.44) MAPTHPGDMEN1KMT2ATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0530511-B1 Silver halide photographic material FUJI PHOTO FILM CO LTD (JP) 1998-06-03 EP disclosed
EP-0534283-B1 Silver halide photographic light-sensitive material FUJI PHOTO FILM CO LTD (JP) 1997-12-17 EP disclosed
US-5422238-A Contains methine compound FUJI PHOTO FILM CO., LTD. (JP) 1995-06-06 US disclosed
US-5290676-A Methine dye sensitizers, controlling size and shape of silver halide grains FUJI PHOTO FILM CO., LTD. (JP) 1994-03-01 US disclosed
EP-0534283-A2 Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1993-03-31 EP disclosed
EP-0530511-A1 Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1993-03-10 EP disclosed