SCHEMBL4952452

SCHEMBL4952452

CCCCC/C=C(\C)OC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.48
ALDH1A1 P00352 1/20 0.40
FAAH O00519 3/20 0.39
TERT O14746 3/20 0.38
PTPN1 P18031 3/20 0.38
PPARG P37231 3/20 0.38
PPARD Q03181 3/20 0.38
PPARA Q07869 3/20 0.38
CYP1A2 P05177 2/20 0.38
MAPT P10636 2/20 0.38
CYP2C19 P33261 2/20 0.38
BLM P54132 2/20 0.38
HSD17B10 Q99714 2/20 0.38
FABP4 P15090 2/20 0.38
F7 P08709 2/20 0.38
F3 P13726 2/20 0.38
KMT2A Q03164 2/20 0.38
GMNN O75496 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL4952458 1.00 EP300 (0.48) EP300ALDH1A1FAAHTERTPTPN1
SCHEMBL19411366 0.98 EP300 (0.52) EP300FAAHTERTPTPN1PPARG
SCHEMBL19411365 0.98 EP300 (0.52) EP300FAAHTERTPTPN1PPARG
SCHEMBL6060318 0.96 ALDH1A1 (0.43) EP300ALDH1A1HSD17B10F7F3
SCHEMBL10532348 0.86 EP300 (0.52) EP300FAAHTERTPTPN1PPARG
SCHEMBL11693855 0.85 EP300 (0.48) EP300FAAHTERTPTPN1PPARG
SCHEMBL27449041 0.85 ALDH1A1 (0.41) EP300ALDH1A1HSD17B10LMNAALOX15
SCHEMBL11801529 0.85 EP300 (0.48) EP300FAAHTERTPTPN1PPARG
SCHEMBL6911093 0.84 TSHR (0.38) EP300ALDH1A1F7F3LMNA
SCHEMBL6911096 0.84 TSHR (0.38) EP300ALDH1A1F7F3LMNA

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-20080221003-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-09-11 US disclosed
US-20080207481-A1 CONSUMER PRODUCTS HAVING VARYING ODORS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-08-28 US disclosed