SCHEMBL4860126

SCHEMBL4860126

CC(C)(C)OC(=O)N1Cc2cc(F)ccc2CC1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 12/20 0.53
PTPN1 P18031 4/20 0.53
OPRD1 P41143 2/20 0.44
OPRM1 P35372 1/20 0.44
OPRK1 P41145 1/20 0.44

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
SCHEMBL14279605 1.00 HDAC8 (0.53) HDAC8PTPN1OPRD1OPRM1OPRK1
SCHEMBL5402857 0.95 HDAC8 (0.48) HDAC8PTPN1
SCHEMBL20720251 0.88 PTPN1 (0.68) HDAC8PTPN1
SCHEMBL29676960 0.88 PTPN1 (0.68) HDAC8PTPN1
SCHEMBL18793348 0.88 PTPN1 (0.68) HDAC8PTPN1
SCHEMBL19460727 0.86 PTPN1 (0.54) HDAC8PTPN1
SCHEMBL30254985 0.86 PTPN1 (0.54) HDAC8PTPN1OPRD1OPRM1OPRK1
SCHEMBL864823 0.86 PTPN1 (0.54) HDAC8PTPN1OPRD1OPRM1OPRK1
SCHEMBL29502321 0.86 PTPN1 (0.54) HDAC8PTPN1OPRD1OPRM1OPRK1
SCHEMBL29773931 0.86 PTPN1 (0.54) HDAC8PTPN1OPRD1OPRM1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7314879-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2008-01-01 US disclosed
US-7169777-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-30 US disclosed
EP-1469851-B1 MELANOCORTIN RECEPTOR AGONISTS LILLY CO ELI (US) 2006-10-11 EP disclosed
US-20050075344-A1 Melanocortin receptor agonists ELI LILLY AND COMPANY 2005-04-07 US disclosed
EP-1469851-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2004-10-27 EP disclosed
US-20040116699-A1 Melanocortin receptor agonists ELI LILLY AND COMPANY 2004-06-17 US disclosed
WO-2003061660-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2003-07-31 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-20050075344-A1 Melanocortin receptor agonists MC4R, MC1R, MC5R HDAC8 3936/4885PTPN1 1855/4885OPRD1 58/4885

“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.