SCHEMBL9723779

SCHEMBL9723779

CCCCC/C=C/CCCCCCCCC(=O)N1CC(C)OC(C)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 3/20 0.49
PTPN1 P18031 3/20 0.49
PPARG P37231 3/20 0.49
PPARD Q03181 3/20 0.49
PPARA Q07869 3/20 0.49
CYP1A2 P05177 2/20 0.49
MAPT P10636 2/20 0.49
CYP2C19 P33261 2/20 0.49
BLM P54132 2/20 0.49
HSD17B10 Q99714 2/20 0.49
FABP4 P15090 2/20 0.49
FAAH O00519 2/20 0.49
KMT2A Q03164 2/20 0.49
GMNN O75496 1/20 0.49
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX15 P16050 1/20 0.49
APEX1 P27695 1/20 0.49

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
SCHEMBL11690104 1.00 TERT (0.49) TERTPTPN1PPARGPPARDPPARA
SCHEMBL9723756 1.00 TERT (0.49) TERTPTPN1PPARGPPARDPPARA
SCHEMBL9723781 1.00 TERT (0.49) TERTPTPN1PPARGPPARDPPARA
SCHEMBL9723747 1.00 TERT (0.49) TERTPTPN1PPARGPPARDPPARA
SCHEMBL11690113 1.00 TERT (0.49) TERTPTPN1PPARGPPARDPPARA
SCHEMBL8972961 0.91 L3MBTL1 (0.53) MAPTCYP2C19KMT2APOLBMEN1
SCHEMBL8972169 0.91 L3MBTL1 (0.53) MAPTCYP2C19KMT2APOLBMEN1
SCHEMBL8972695 0.91 L3MBTL1 (0.53) MAPTCYP2C19KMT2APOLBMEN1
SCHEMBL8972586 0.91 L3MBTL1 (0.53) MAPTCYP2C19KMT2APOLBMEN1
SCHEMBL8972946 0.91 L3MBTL1 (0.53) MAPTCYP2C19KMT2APOLBMEN1

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
EP-0368933-B1 COMPOSITIONS COMPRISING 1-OXO- OR THIOHYDROCARBYL SUBSTITUTED AZACYCLOALKANES Whitby Research Incorporated (US) 1992-10-14 EP claimed
EP-0368933-B1 COMPOSITIONS COMPRISING 1-OXO- OR THIOHYDROCARBYL SUBSTITUTED AZACYCLOALKANES Whitby Research Incorporated (US) 1992-10-14 EP disclosed
EP-0368933-A1 COMPOSITIONS COMPRISING 1-OXO- OR THIOHYDROCARBYL SUBSTITUTED AZACYCLOALKANES Whitby Research Incorporated (US) 1990-05-23 EP disclosed