SCHEMBL30301574

SCHEMBL30301574

Cc1c(O)cc(O)c(C(=O)N2Cc3ccc(CN4CCN(C)CC4)cc3C2)c1OCC1CC1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.56
HSP90AB1 P08238 2/20 0.56
HSP90B1 P14625 1/20 0.56
MCHR1 Q99705 5/20 0.40
ROCK1 Q13464 2/20 0.40
ROCK2 O75116 2/20 0.38
NAMPT P43490 2/20 0.38
ACACB O00763 5/20 0.38
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL30301590 0.96 HSP90AA1 (0.54) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK1
SCHEMBL30301565 0.89 HSP90AA1 (0.62) HSP90AA1HSP90AB1HSP90B1ROCK1ROCK2
SCHEMBL30301601 0.88 HSP90AA1 (0.61) HSP90AA1HSP90AB1HSP90B1ROCK1ROCK2
SCHEMBL25205369 0.87 HSP90AA1 (0.44) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK1
SCHEMBL30462406 0.87 HSP90AA1 (0.44) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK1
SCHEMBL30301547 0.85 HSP90AA1 (0.56) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK1
SCHEMBL25222618 0.85 HSP90AA1 (0.56) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK1
SCHEMBL25221649 0.80 HSP90AA1 (0.42) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK1
SCHEMBL30368298 0.80 HSP90AA1 (0.42) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK1
SCHEMBL31281713 0.79 PARP15 (0.36) HSP90AA1HSP90AB1HSP90B1NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12552758-B2 Inhibitors of MLH1 and/or PMS2 for cancer treatment Neophore Limited (GB) 2026-02-17 US claimed
CN-115996907-A Inhibitors of MLH1 and/or PMS2 for cancer treatment 奈奥芬莱有限公司 2023-04-21 CN claimed
EP-4157463-A1 INHIBITORS OF MLH1 AND/OR PMS2 FOR CANCER TREATMENT Neophore Limited (GB) 2023-04-05 EP claimed
CN-115996907-A Inhibitors of MLH1 and/or PMS2 for cancer treatment 奈奥芬莱有限公司 2023-04-21 CN disclosed
EP-4157463-A1 INHIBITORS OF MLH1 AND/OR PMS2 FOR CANCER TREATMENT Neophore Limited (GB) 2023-04-05 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-12552758-B2 Inhibitors of MLH1 and/or PMS2 for cancer treatment MSH2, PMS2, MSH6 HSP90AA1 2502/4885HSP90AB1 1847/4885HSP90B1 3336/4885

“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.