SCHEMBL25256891

SCHEMBL25256891

Cc1c(O)cc(O)c(C(=O)N2Cc3ccc(CN4CCOCC4)cc3C2)c1OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.46
HSP90AB1 P08238 2/20 0.46
HSP90B1 P14625 1/20 0.46
MCHR1 Q99705 1/20 0.44
ROCK2 O75116 1/20 0.41
NAMPT P43490 1/20 0.41
KDM4E B2RXH2 3/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 2/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL30368354 1.00 HSP90AA1 (0.46) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK2
SCHEMBL25222618 0.91 HSP90AA1 (0.56) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK2
SCHEMBL30301547 0.91 HSP90AA1 (0.56) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK2
SCHEMBL30462394 0.90 HSP90AA1 (0.46) HSP90AA1HSP90AB1HSP90B1KDM4ELMNA
SCHEMBL25204918 0.90 HSP90AA1 (0.46) HSP90AA1HSP90AB1HSP90B1KDM4ELMNA
SCHEMBL25244479 0.86 HTT (0.41) HSP90AA1MCHR1KDM4ELMNASMN1; SMN2
SCHEMBL30368391 0.86 HTT (0.41) HSP90AA1MCHR1KDM4ELMNASMN1; SMN2
SCHEMBL24913840 0.86 MEN1 (0.44) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK2
SCHEMBL30789165 0.86 MEN1 (0.44) HSP90AA1HSP90AB1HSP90B1MCHR1ROCK2
SCHEMBL30368189 0.85 HSP90AA1 (0.48) HSP90AA1HSP90AB1HSP90B1LMNAHPGD

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 4 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
US-20230183197-A1 INHIBITORS OF MLH1 AND/OR PMS2 FOR CANCER TREATMENT Neophore Limited (GB) 2023-06-15 US disclosed
US-20230183197-A1 INHIBITORS OF MLH1 AND/OR PMS2 FOR CANCER TREATMENT Neophore Limited (GB) 2023-06-15 US disclosed
US-20230183197-A1 INHIBITORS OF MLH1 AND/OR PMS2 FOR CANCER TREATMENT Neophore Limited (GB) 2023-06-15 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 (2 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
US-20230183197-A1 INHIBITORS OF MLH1 AND/OR PMS2 FOR CANCER TREATMENT MSH2, PMS2, MSH6 HSP90AA1 1915/4885HSP90AB1 1434/4885HSP90B1 2130/4885

“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.