SCHEMBL5888451

SCHEMBL5888451

CC(C)(C)OC(=O)N1C(=O)CCC[C@@H]1Cc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 3/20 0.47
PRMT5 O14744 4/20 0.44
CHRNB2 P17787 1/20 0.44
CHRNA5 P30532 1/20 0.44
CHRNA7 P36544 1/20 0.44
CHRNA4 P43681 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM4C Q9H3R0 1/20 0.43
LMNA P02545 1/20 0.43
KLK7 P49862 1/20 0.42
PARP1 P09874 1/20 0.42
GHSR Q92847 3/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
S1PR5 Q9H228 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL5888448 1.00 YAP1 (0.47) YAP1PRMT5CHRNB2CHRNA5CHRNA7
SCHEMBL29997809 0.90 KLK7 (0.48) KMT2AKLK7PARP1
SCHEMBL6969013 0.90 KLK7 (0.48) KMT2AKLK7PARP1
SCHEMBL19419776 0.84 KLK7 (0.51) KLK7PARP1
SCHEMBL3728443 0.84 KLK7 (0.51) KLK7PARP1
SCHEMBL15383781 0.84 KLK7 (0.51) KLK7PARP1
SCHEMBL5966655 0.82 HCRTR1 (0.42) MEN1KMT2ALMNAKLK7TP53
SCHEMBL13701096 0.81 YAP1 (0.47) YAP1PRMT5GHSRTP53
SCHEMBL5887627 0.80 YAP1 (0.44) YAP1PRMT5MEN1KMT2AKDM4C
SCHEMBL598705 0.80 KLK7 (0.45) KLK7PARP1

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
US-7026335-B2 Melanocortin receptor ligands THE PROCTER & GAMBLE CO. (US) 2006-04-11 US disclosed
CN-1656070-A Melanocortin receptor ligands PROCTER & GAMBLE (US) 2005-08-17 CN disclosed
US-20050171158-A1 Melanocortin receptor ligands EBETINO FRANK H (US) 2005-08-04 US disclosed
EP-1499588-A1 MELANOCORTIN RECEPTOR LIGANDS THE PROCTER & GAMBLE COMPANY (US) 2005-01-26 EP disclosed
US-20030236230-A1 Melanocortin receptor ligands THE PROCTER & GAMBLE COMPANY 2003-12-25 US disclosed
WO-2003093234-A1 MELANOCORTIN RECEPTOR LIGANDS THE PROCTER & GAMBLE COMPANY (US) 2003-11-13 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 (2 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-20050171158-A1 Melanocortin receptor ligands MC1R, MC4R, MC5R YAP1 786/4885PRMT5 489/4885CHRNB2 443/4885
US-20030236230-A1 Melanocortin receptor ligands MC1R, MC4R, MC5R YAP1 911/4885PRMT5 387/4885CHRNB2 442/4885

“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.