SCHEMBL4500701

SCHEMBL4500701

O=C1C(Cc2c(Cl)cccc2Cl)CCN1C1CCSCC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.48
LMNA P02545 2/20 0.34
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP2A13 Q16696 1/20 0.33
ROCK2 O75116 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 2/20 0.32

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
SCHEMBL3553955 0.86 HSD11B1 (0.64) HSD11B1LMNAHTTNPSR1ALDH1A1
SCHEMBL4512741 0.85 HSD11B1 (0.49) HSD11B1LMNAROCK2ALDH1A1KMT2A
SCHEMBL2989122 0.84 HSD11B1 (0.48) HSD11B1LMNAALDH1A1KMT2AMAPT
SCHEMBL4526228 0.84 HSD11B1 (0.48) HSD11B1LMNAHTTNPSR1CYP2A13
SCHEMBL2989117 0.84 HSD11B1 (0.48) HSD11B1LMNAALDH1A1KMT2AMAPT
SCHEMBL4519820 0.84 HSD11B1 (0.48) HSD11B1LMNAROCK2
SCHEMBL4514552 0.84 HSD11B1 (0.48) HSD11B1LMNAALDH1A1KMT2AMAPT
SCHEMBL4524935 0.83 HSD11B1 (0.50) HSD11B1LMNAROCK2ALDH1A1KMT2A
SCHEMBL4518540 0.83 HSD11B1 (0.50) HSD11B1LMNAALDH1A1KMT2AMAPT
SCHEMBL4511224 0.82 HSD11B1 (0.46) HSD11B1LMNAALDH1A1KMT2AMAPT

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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 EP disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885LMNA 2846/4885HTT 3659/4885

“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.