SCHEMBL13744477

SCHEMBL13744477

COC(=O)C1=C(O)C[C@H](c2ccccc2)NC1=O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LDHA P00338 3/20 0.54
LDHB P07195 1/20 0.48
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.43
PAX8 Q06710 1/20 0.43
LMNA P02545 4/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
HPGD P15428 1/20 0.40
BUB1 O43683 1/20 0.39
RECQL P46063 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
SCHEMBL13744250 1.00 LDHA (0.54) LDHALDHBKMT2AMEN1ALDH1A1
SCHEMBL4238503 1.00 LDHA (0.54) LDHALDHBKMT2AMEN1ALDH1A1
SCHEMBL4237768 0.83 LDHA (0.57) LDHALDHBKMT2AMEN1ALDH1A1
SCHEMBL4241399 0.83 LDHA (0.57) LDHALDHBKMT2AMEN1ALDH1A1
SCHEMBL4238229 0.79 KMT2A (0.51) KMT2AMEN1ALDH1A1PAX8LMNA
SCHEMBL4242864 0.79 NPC1 (0.50) LDHAKMT2AMEN1ALDH1A1RAB9A
SCHEMBL4244324 0.79 ALDH1A1 (0.41) KMT2AMEN1ALDH1A1LMNAHPGD
SCHEMBL4380936 0.75 LDHA (0.49) LDHALDHBKMT2AMEN1ALDH1A1
SCHEMBL4384687 0.75 LDHA (0.49) LDHALDHBKMT2AMEN1ALDH1A1
SCHEMBL4248057 0.75 LDHA (0.49) LDHALDHBKMT2AMEN1ALDH1A1

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-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 LDHA 3026/4885LDHB 2683/4885KMT2A 4780/4885

“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.