SCHEMBL10219945

SCHEMBL10219945

Cc1cc(O)cc(CN2C(C)CN(c3nc4ccc(Cl)cc4s3)CC2C)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.46
RAB9A P51151 6/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
PPARG P37231 6/20 0.46
PPARD Q03181 6/20 0.46
PPARA Q07869 6/20 0.46
HCRTR1 O43613 5/20 0.43
HCRTR2 O43614 5/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL10271124 0.91 PPARG (0.47) NPC1RAB9ASMN1; SMN2PPARGPPARD
SCHEMBL10220021 0.88 PPARG (0.60) NPC1RAB9ASMN1; SMN2PPARGPPARD
SCHEMBL10220023 0.88 PPARG (0.60) NPC1RAB9ASMN1; SMN2PPARGPPARD
SCHEMBL10220815 0.87 PPARD (0.61) PPARGPPARDPPARA
SCHEMBL10219947 0.86 PPARD (0.62) PPARGPPARDPPARA
SCHEMBL10219445 0.85 PPARG (0.48) NPC1RAB9ASMN1; SMN2PPARGPPARD
SCHEMBL10219466 0.85 PPARD (0.53) NPC1RAB9APPARGPPARDPPARA
SCHEMBL10271365 0.83 PPARG (0.49) NPC1RAB9ASMN1; SMN2PPARGPPARD
SCHEMBL10220268 0.83 PPARD (0.61) PPARGPPARDPPARA
SCHEMBL334262 0.83 PPARD (0.56) NPC1RAB9ASMN1; SMN2PPARGPPARD

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 NPC1 1742/4885RAB9A 1784/4885SMN1; SMN2 4505/4885

“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.