SCHEMBL9745146

SCHEMBL9745146

CCCCCCCC/C=C/CCCCCCCC(=O)C#N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 3/20 0.61
PTPN1 P18031 3/20 0.61
PPARG P37231 3/20 0.61
PPARD Q03181 3/20 0.61
PPARA Q07869 3/20 0.61
CYP1A2 P05177 2/20 0.61
MAPT P10636 2/20 0.61
CYP2C19 P33261 2/20 0.61
BLM P54132 2/20 0.61
HSD17B10 Q99714 2/20 0.61
FABP4 P15090 2/20 0.61
FAAH O00519 2/20 0.61
KMT2A Q03164 2/20 0.61
F7 P08709 2/20 0.61
F3 P13726 2/20 0.61
DUSP3 P51452 2/20 0.61
GMNN O75496 1/20 0.61
USP2 O75604 1/20 0.61
LMNA P02545 1/20 0.61
POLB P06746 1/20 0.61

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
SCHEMBL19011847 1.00 TERT (0.61) TERTPTPN1PPARGPPARDPPARA
SCHEMBL8814525 1.00 TERT (0.61) TERTPTPN1PPARGPPARDPPARA
SCHEMBL28441296 0.95 ALDH1A1 (0.65) PPARGPPARDPPARAMAPTBLM
SCHEMBL28312201 0.88 CES2 (0.54) PTPN1PPARGPPARDPPARAHSD17B10
SCHEMBL9743864 0.88 CES2 (0.54) PTPN1PPARGPPARDPPARAHSD17B10
SCHEMBL28626065 0.88 CES2 (0.54) PTPN1PPARGPPARDPPARAHSD17B10
SCHEMBL1019049 0.86
SCHEMBL5052242 0.81 TERT (0.61) TERTPTPN1PPARGPPARDPPARA
SCHEMBL32674589 0.81 FAAH (0.64) TERTPTPN1PPARGPPARDPPARA
SCHEMBL3065252 0.81 TERT (0.61) TERTPTPN1PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5173365-A Ultra-thin molecular film NANOFILM CORPORATION (US) 1992-12-22 US disclosed
US-5106561-A Amphiphilic molecules orientated in two directions NANOFILM CORPORATION (US) 1992-04-21 US disclosed
EP-0386962-A2 Ultra-thin self-assembling molecular films and apparatus and method for making them and applying them to surfaces NANOFILM CORPORATION (US) 1990-09-12 EP disclosed