SCHEMBL8522575

SCHEMBL8522575

O=CCCCCOS(=O)(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.41
FNTB P49356 2/20 0.41
HIF1A Q16665 1/20 0.39
CA1 P00915 10/20 0.37
CA2 P00918 10/20 0.37
CA9 Q16790 10/20 0.37
TSHR P16473 3/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MMP9 P14780 1/20 0.37
ALOX15 P16050 1/20 0.37
CA12 O43570 2/20 0.36
CA3 P07451 2/20 0.36
CA4 P22748 2/20 0.36
CA6 P23280 2/20 0.36
CA5A P35218 2/20 0.36
CA7 P43166 2/20 0.36
CA14 Q9ULX7 2/20 0.36

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
SCHEMBL3263854 0.98 FNTA (0.43) FNTAFNTBHIF1ACA1CA2
SCHEMBL6704245 0.98 FNTA (0.43) FNTAFNTBHIF1ACA1CA2
Ammonia Solution, Strong SCHEMBL29176449 0.96 FNTA (0.42) FNTAFNTBHIF1ACA1CA2
SCHEMBL27954060 0.89 TSHR (0.57) CA1CA2CA9TSHRCA12
Olealdehyde SCHEMBL4961202 0.84 FAAH (0.61) CA1CA2CA9TSHRCA12
SCHEMBL7036524 0.83
SCHEMBL3640927 0.83 CA2 (0.50) FNTAFNTBCA1CA2CA9
Methane SCHEMBL6196689 0.81 CA2 (0.33) FNTAFNTBHIF1ACA2CA9
SCHEMBL5788200 0.80 FNTA (0.53) FNTAFNTBCA1CA2CA9
SCHEMBL17456416 0.80 FNTA (0.48) FNTAFNTBCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948307-A2 PROCESS Colgate-Palmolive Company (US) 1999-10-13 EP disclosed
WO-1998025577-A2 PROCESS FOR HYDRATING A GELLING AGENT COLGATE-PALMOLIVE COMPANY (US) 1998-06-18 WO disclosed