SCHEMBL13675546

SCHEMBL13675546

O=C1C(Cc2ccc(CO)cc2Cl)CCN1C1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 10/20 0.55
P2RX7 Q99572 2/20 0.36
HRH3 Q9Y5N1 1/20 0.35
KDM2B Q8NHM5 1/20 0.35
TP53 P04637 2/20 0.35
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL4518301 0.89 HSD11B1 (0.51) HSD11B1P2RX7HRH3TP53ALDH1A1
SCHEMBL4504216 0.87 HSD11B1 (0.47) HSD11B1HRH3
SCHEMBL4519281 0.86 HSD11B1 (0.53) HSD11B1P2RX7HRH3LMNA
SCHEMBL4512444 0.86 HSD11B1 (0.54) HSD11B1P2RX7ALDH1A1SMN1; SMN2LMNA
SCHEMBL3000826 0.85 HSD11B1 (0.56) HSD11B1P2RX7
SCHEMBL2991795 0.85 HSD11B1 (0.56) HSD11B1P2RX7
SCHEMBL2995925 0.85 HSD11B1 (0.65) HSD11B1HRH3TP53ALDH1A1SMN1; SMN2
SCHEMBL4522654 0.85 HSD11B1 (0.49) HSD11B1P2RX7HRH3TP53ALDH1A1
SCHEMBL3555104 0.84 HSD11B1 (0.55) HSD11B1P2RX7ALDH1A1SMN1; SMN2LMNA
SCHEMBL2990822 0.83 HSD11B1 (0.54) HSD11B1P2RX7ALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885P2RX7 3946/4885HRH3 3961/4885

“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.