SCHEMBL12799601

SCHEMBL12799601

C/C=C(/CCCCCCCCC/C=C/CCCCCC)OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 3/20 0.53
PTPN1 P18031 3/20 0.53
PPARG P37231 3/20 0.53
PPARD Q03181 3/20 0.53
PPARA Q07869 3/20 0.53
FAAH O00519 3/20 0.53
CYP1A2 P05177 2/20 0.53
MAPT P10636 2/20 0.53
CYP2C19 P33261 2/20 0.53
BLM P54132 2/20 0.53
HSD17B10 Q99714 2/20 0.53
FABP4 P15090 2/20 0.53
KMT2A Q03164 2/20 0.53
GMNN O75496 1/20 0.53
USP2 O75604 1/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 1/20 0.53
CYP2C9 P11712 1/20 0.53
ALOX15 P16050 1/20 0.53
APEX1 P27695 1/20 0.53

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
SCHEMBL6933653 0.86 TERT (0.55) TERTPTPN1PPARGPPARDPPARA
SCHEMBL11467729 0.80 EP300 (0.44) TERTPTPN1PPARGPPARDPPARA
SCHEMBL11467728 0.80 EP300 (0.44) TERTPTPN1PPARGPPARDPPARA
SCHEMBL9811795 0.77 EPHX2 (0.73) TERTPTPN1PPARGPPARDPPARA
SCHEMBL10085307 0.77 EPHX2 (0.73) TERTPTPN1PPARGPPARDPPARA
Methyl Oleate SCHEMBL25202566 0.77 EPHX2 (0.73) TERTPTPN1PPARGPPARDPPARA
SCHEMBL583989 0.77 EPHX2 (0.73) TERTPTPN1PPARGPPARDPPARA
SCHEMBL23918136 0.77 EPHX2 (0.73) TERTPTPN1PPARGPPARDPPARA
SCHEMBL20991368 0.77 EPHX2 (0.73) TERTPTPN1PPARGPPARDPPARA
SCHEMBL24751538 0.77 EPHX2 (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011045536-A1 NOVEL METHOD FOR PREPARING POLYOLS BY MEANS OF THIOLATION AND PRODUCTS SUCH AS THOSE OBTAINED CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2011-04-21 WO disclosed