SCHEMBL4237733

SCHEMBL4237733

COC(=O)c1c(O)cc(-c2ccccc2)oc1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CYP2C19 P33261 2/20 0.46
HTT P42858 1/20 0.46
NPC1 O15118 1/20 0.46
ABCB1 P08183 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.46
KDM4E B2RXH2 2/20 0.45
GABRP O00591 1/20 0.45

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
SCHEMBL5632532 0.83 SMN1; SMN2 (0.72) POLBSMN1; SMN2L3MBTL1CA12CA1
SCHEMBL4244247 0.83 SMN1; SMN2 (0.77) POLBSMN1; SMN2L3MBTL1CA12CA1
SCHEMBL15154936 0.82 L3MBTL1 (0.48) POLBSMN1; SMN2L3MBTL1HTTMAPT
SCHEMBL7370116 0.80 SMN1; SMN2 (1.00) POLBSMN1; SMN2L3MBTL1CA12CA1
SCHEMBL4369997 0.80 SMN1; SMN2 (0.72) POLBSMN1; SMN2L3MBTL1CA12CA1
SCHEMBL10462843 0.77 TNKS (0.51) SMN1; SMN2L3MBTL1CYP2C19NPC1ABCB1
SCHEMBL7123718 0.77 ALDH1A1 (0.48) POLBSMN1; SMN2L3MBTL1HTTMAPT
SCHEMBL6505800 0.76 CA12 (0.62) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL6053334 0.75 ALDH1A1 (0.46) CA12CA1CA2CA7CA9
SCHEMBL3513442 0.75 SMN1; SMN2 (0.56) POLBSMN1; SMN2L3MBTL1CA12CA1

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-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US 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-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE FDPS, UMPS, GGPS1 POLB 470/4885SMN1; SMN2 4143/4885L3MBTL1 2061/4885

“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.