SCHEMBL10219983

SCHEMBL10219983

Cc1cc(O)cc(CN2CCCN(c3nc4cc(F)c(C(F)(F)F)cc4s3)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 11/20 0.52
PPARG P37231 9/20 0.52
PPARA Q07869 8/20 0.52
HRH3 Q9Y5N1 1/20 0.39
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
BRD4 O60885 1/20 0.36

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
SCHEMBL10220584 0.88 PPARD (0.69) PPARDPPARGPPARAHRH3RAB9A
SCHEMBL10219481 0.86 PPARD (0.51) PPARDPPARGPPARAHRH3RAB9A
SCHEMBL10219580 0.85 PPARD (0.57) PPARDPPARGPPARAHRH3RAB9A
SCHEMBL10219941 0.85 PPARD (0.72) PPARDPPARGPPARAHRH3RAB9A
SCHEMBL10220257 0.84 PPARD (0.56) PPARDPPARGPPARARAB9A
SCHEMBL10220581 0.84 PPARD (0.73) PPARDPPARGPPARARAB9ANPC1
SCHEMBL10219981 0.83 PPARD (0.59) PPARDPPARGPPARA
SCHEMBL10220098 0.83 PPARD (0.48) PPARDPPARGPPARARAB9ANPC1
SCHEMBL10219988 0.82 PPARD (0.48) PPARDPPARGPPARA
SCHEMBL10219985 0.81 PPARD (0.47) PPARDPPARGPPARA

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 1/4885PPARG 3/4885PPARA 2/4885

“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.