SCHEMBL4517653

SCHEMBL4517653

O=C(NCc1c(Cl)cccc1Cl)C1CCN(C2CCCCC2)C1=O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 9/20 0.49
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 4/20 0.44

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
SCHEMBL4511149 0.89 KMT2A (0.46) P2RX7LMNAHTTSMN1; SMN2ALDH1A1
SCHEMBL4505216 0.82 ALDH1A1 (0.48) P2RX7LMNAALDH1A1
SCHEMBL4520615 0.80 CYP2C19 (0.51) SMN1; SMN2ALDH1A1
SCHEMBL13674417 0.78 HTT (0.49) P2RX7LMNAHTTSMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL4515837 0.77 HTT (0.51) P2RX7LMNAHTTSMN1; SMN2ALDH1A1
SCHEMBL3553955 0.75 HSD11B1 (0.64) LMNAHTTSMN1; SMN2ALDH1A1
SCHEMBL2988726 0.73 HSD11B1 (0.59) LMNASMN1; SMN2ALDH1A1
SCHEMBL2990265 0.73 HSD11B1 (0.59) LMNASMN1; SMN2ALDH1A1
SCHEMBL2988725 0.73 HSD11B1 (0.59) LMNASMN1; SMN2ALDH1A1
SCHEMBL3002320 0.72 HSD11B1 (0.57) P2RX7LMNAHTTSMN1; SMN2ALDH1A1

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 P2RX7 3946/4885LMNA 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.