SCHEMBL2901274

SCHEMBL2901274

COC(=O)c1cc(C)c(C(=O)OC)c(N=C=S)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.41
ACHE P22303 1/20 0.41
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
HPGD P15428 1/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
KDM4E B2RXH2 4/20 0.39
POLB P06746 3/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
NFKB1 P19838 1/20 0.39
XDH P47989 1/20 0.39
GFER P55789 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
FUT7 Q11130 1/20 0.39

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
SCHEMBL2897042 0.84 MAPT (0.41) CYP3A4CA1CA2HPGDCA12
SCHEMBL2895172 0.84 CA1 (0.39) CYP3A4CA1CA2HPGDCA12
SCHEMBL7119247 0.80 CA1 (0.45) CA1CA2HPGDCA12CA7
SCHEMBL3320428 0.80 CA1 (0.45) CA1CA2HPGDCA12CA7
SCHEMBL70139 0.78 CYP3A4 (0.57) CYP3A4ACHECA1CA2HPGD
SCHEMBL3003942 0.76 TPMT (0.38) CYP3A4ACHECA1CA2CA12
SCHEMBL2900923 0.74 KDM4E (0.53) CA1CA2HPGDCA12CA7
SCHEMBL18029472 0.73 MAPT (0.36) CYP3A4ACHECA1CA2HPGD
SCHEMBL6118516 0.73 MAPT (0.53) CYP3A4CA1CA2HPGDCA12
SCHEMBL2901256 0.72 PDGFRB (0.37) CYP3A4ACHECA1CA2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298324-A1 Prolyl Hydroxylase Inhibitors SMITH KLINE BEECHAM CORPORATION (US) 2010-11-25 US disclosed
EP-2240178-A1 PROLYL HYDROXYLASE INHIBITORS GlaxoSmithKline LLC (US) 2010-10-20 EP disclosed
WO-2009086044-A1 PROLYL HYDROXYLASE INHIBITORS SMITH KLINE BEECHAM CORPORATION (US) 2009-07-09 WO 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-20100298324-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN3, EGLN2 CYP3A4 603/4885ACHE 4877/4885CA1 2100/4885

“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.