SCHEMBL10219878

SCHEMBL10219878

CCOC(=O)c1ccccc1OCCN1CCN(c2nc3ccc(Cl)cc3s2)CC1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 11/20 0.64
NPC1 O15118 6/20 0.52
RAB9A P51151 4/20 0.52
PPARG P37231 10/20 0.51
PPARA Q07869 9/20 0.51
HCRTR1 O43613 1/20 0.49
HCRTR2 O43614 1/20 0.49
MAPT P10636 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PCSK9 Q8NBP7 1/20 0.47

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
SCHEMBL10220160 0.89 PPARD (0.66) PPARDNPC1RAB9APPARGPPARA
SCHEMBL10219884 0.87 PPARD (0.65) PPARDNPC1RAB9APPARGPPARA
SCHEMBL10219857 0.85 PPARG (0.55) PPARDNPC1RAB9APPARGPPARA
SCHEMBL10219886 0.84 PPARD (0.61) PPARDNPC1RAB9APPARGPPARA
SCHEMBL10219880 0.84 PPARD (0.59) PPARDNPC1RAB9APPARGPPARA
SCHEMBL10219891 0.79 PPARD (0.64) PPARDNPC1RAB9APPARGPPARA
SCHEMBL10219910 0.79 PPARD (0.79) PPARDNPC1RAB9APPARGPPARA
SCHEMBL10219912 0.79 PPARD (0.69) PPARDPPARGPPARA
SCHEMBL10220794 0.78 PPARD (1.00) PPARDPPARGPPARA
SCHEMBL14144180 0.77 PPARD (0.62) PPARDNPC1RAB9APPARGPPARA

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-8097610-B2 Derivative having PPAR agonistic activity SHIONOGI & CO., LTD. (JP) 2012-01-17 US disclosed
US-8097610-B2 Derivative having PPAR agonistic activity SHIONOGI & CO., LTD. (JP) 2012-01-17 US disclosed
US-20090286974-A1 Derivative having ppar agonistic activity SHIONOGI & CO., LTD. (JP) 2009-11-19 US disclosed
US-20090286974-A1 Derivative having ppar agonistic activity SHIONOGI & CO., LTD. (JP) 2009-11-19 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-20090286974-A1 Derivative having ppar agonistic activity PPARD, PPARA, PPARG PPARD 1/4885NPC1 1742/4885RAB9A 1784/4885

“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.