SCHEMBL5215263

SCHEMBL5215263

Cc1oc(-c2ccc(Sc3ccccc3)cc2)nc1C(C)CO

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
KDM4E B2RXH2 1/20 0.40
TARBP2 Q15633 2/20 0.39
MAPT P10636 5/20 0.37
HPGD P15428 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
SLC6A4 P31645 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TP53 P04637 3/20 0.35
KDR P35968 1/20 0.35
POLB P06746 3/20 0.35
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL6615721 0.85 RAB9A (0.39) RAB9ANPC1KDM4ETARBP2MAPT
SCHEMBL5217558 0.80 TARBP2 (0.49) RAB9ANPC1KDM4ETARBP2MAPT
SCHEMBL4484956 0.76 PTPN1 (0.47) PPARGPPARA
SCHEMBL4467290 0.76 PTPN1 (0.47) PPARGPPARA
SCHEMBL18924759 0.75 KDM4E (0.48) RAB9ANPC1KDM4ETARBP2MAPT
SCHEMBL14432417 0.74 ACACB (0.40) RAB9ANPC1PPARGPPARAKDR
SCHEMBL5850817 0.73 PPARG (0.48) PPARGPPARA
SCHEMBL3886258 0.71 KDM4E (0.50) RAB9ANPC1KDM4ETARBP2MAPT
SCHEMBL17540833 0.71 KDM4E (0.49) RAB9ANPC1KDM4ETARBP2MAPT
SCHEMBL7737637 0.68 KDM4E (0.46) RAB9ANPC1KDM4ETARBP2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480640-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2007-08-15 EP disclosed
EP-1480640-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2007-08-15 EP disclosed
US-7153878-B2 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2006-12-26 US disclosed
US-20050107449-A1 Peroxisome proliferator activated receptor modulators ELILILLY AND COMPANY 2005-05-19 US disclosed
EP-1480640-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-12-01 EP disclosed
WO-2003072100-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-04 WO 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-20050107449-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD RAB9A 3861/4885NPC1 613/4885KDM4E 4081/4885

“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.