SCHEMBL6208470

SCHEMBL6208470

CCCCC(Cl)S(C)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.36
TP53 P04637 1/20 0.35
DNM1 Q05193 2/20 0.35
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
FDPS P14324 1/20 0.34
MAPK1 P28482 1/20 0.33
CA1 P00915 2/20 0.32
CA12 O43570 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
ALDH1A1 P00352 2/20 0.31
FAAH O00519 2/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL9481755 0.82 CA2 (0.38) CA2TP53DNM1TSHRSMN1; SMN2
SCHEMBL9170810 0.80 CA2 (0.36) CA2TP53DNM1TSHRSMN1; SMN2
SCHEMBL28313790 0.80 CA2 (0.36) CA2TP53DNM1TSHRSMN1; SMN2
SCHEMBL8521185 0.78 TP53 (0.43) CA2TP53DNM1TSHRSMN1; SMN2
SCHEMBL1692881 0.78 CA2 (0.48) CA2TP53CA1CA12CA7
SCHEMBL17710323 0.76 CA2 (0.38) CA2TP53DNM1TSHRSMN1; SMN2
SCHEMBL27077587 0.73
SCHEMBL181188 0.73
SCHEMBL14892606 0.72 TP53 (0.37) CA2TP53DNM1TSHRSMN1; SMN2
SCHEMBL5637608 0.72 TP53 (0.46) CA2TP53DNM1TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103193840-A Macrolide derivative TAISHO PHARMACEUTICAL CO LTD 2013-07-10 CN disclosed
CN-101454334-B Macrolide derivatives TAISHO PHARMACEUTICAL CO LTD 2013-04-10 CN disclosed
CN-101454334-A Macrolide derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 2009-06-10 CN disclosed
CN-1275964-C 7-oxo pyridopyrimidines as inhibitors of a cellular proliferation HOFFMANN LA ROCHE (CH) 2006-09-20 CN disclosed
EP-1549632-A4 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS DIMENSIONAL PHARM INC (US) 2005-11-09 EP disclosed
EP-1549632-A1 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2005-07-06 EP disclosed
WO-2003099805-A1 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2003-12-04 WO disclosed
CN-1451005-A 7-oxopyridopyrimidines as inhibitors of cell proliferation HOFFMANN LA ROCHE (CH) 2003-10-22 CN disclosed
CN-1058780-A Has the active thiazolidine carboxylic acid amides derivative of anti-allergy, their preparation and application SANKYO CO (JP) 1992-02-19 CN disclosed