SCHEMBL6487134

SCHEMBL6487134

COC(=O)C(=Cc1ccc(OCCn2c(=O)sc3cc(C(=O)c4ccccc4)ccc32)cc1)C(=O)OC

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.68
SIGMAR1 Q99720 1/20 0.54
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
LMNA P02545 1/20 0.49
PPARA Q07869 12/20 0.48
ALDH1A1 P00352 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TP53 P04637 1/20 0.47
ESR1 P03372 1/20 0.43
ESR2 Q92731 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
SCHEMBL6477169 0.91 PPARG (0.64) PPARGSIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL5913749 0.89 PPARG (0.61) PPARGSIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL5913753 0.89 PPARG (0.61) PPARGSIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL6476453 0.88 PPARG (0.60) PPARGSIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL6531209 0.87 PPARG (0.59) PPARGSIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL6476081 0.86 PPARG (0.67) PPARGSIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL6477124 0.86 RAB9A (0.67) PPARGNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL27491368 0.86 SIGMAR1 (0.54) PPARGSIGMAR1LMNATP53
SCHEMBL6483931 0.86 PPARG (0.68) PPARGSIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL6483928 0.86 PPARG (0.68) PPARGSIGMAR1NPC1RAB9ASMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919362-B2 Heterocyclic derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2005-07-19 US disclosed
US-20030040533-A1 Novel heterocyclic derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2003-02-27 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-20030040533-A1 Novel heterocyclic derivatives, preparation method and pharmaceutical compositions containing same CYP2F1, CYP11B2, CYP4B1 PPARG 414/4885SIGMAR1 153/4885NPC1 1716/4885

“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.