SCHEMBL2884178

SCHEMBL2884178

CS(=O)(=O)OCCc1ccc(CC2OCCCO2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 1/20 0.34
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
PPARA Q07869 3/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MMP9 P14780 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
PPARG P37231 1/20 0.31
POLB P06746 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL6223412 0.83 ALDH1A1 (0.39) CA1CA2CA9PKMSMN1; SMN2
SCHEMBL3258334 0.78 CA2 (0.50) CA1CA2CA9SMN1; SMN2PPARA
SCHEMBL9084520 0.77 KDM4C (0.44) CA1CA2CA9NPC1RAB9A
SCHEMBL21901766 0.77 CA2 (0.36) CA1CA2CA9SMN1; SMN2NPC1
SCHEMBL1246773 0.73 CA2 (0.48) CA1CA2CA9PPARALMNA
SCHEMBL2882191 0.73 CA2 (0.43) CA1CA2CA9PKMSMN1; SMN2
SCHEMBL24041849 0.71 MEN1 (0.43) NPC1RAB9APPARAPPARG
SCHEMBL13527822 0.71 CA2 (0.50) CA1CA2CA9SMN1; SMN2LMNA
SCHEMBL6991225 0.71 CA1 (0.48) CA1CA2CA9NPC1LMNA
SCHEMBL17891745 0.71 CA2 (0.44) CA1CA2CA9SMN1; SMN2TP53

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
US-20100216758-A1 Pyridone Compounds MSD K.K. (JP) 2010-08-26 US disclosed
EP-1916239-A1 PYRIDONE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-04-30 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100216758-A1 Pyridone Compounds NPY1R, MC5R, MC1R CA1 4878/4885CA2 4358/4885CA9 4762/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.