SCHEMBL13858558

SCHEMBL13858558

COC(=O)C1(C(=O)OC)CC=C(CC/C=C(\C)CCC=C(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.43
FNTB P49356 2/20 0.43
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 1/20 0.41
PTPN1 P18031 1/20 0.37
PSEN1 P49768 2/20 0.37
ALOX15 P16050 1/20 0.36
TRPV1 Q8NER1 2/20 0.36

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
SCHEMBL13858559 1.00 FNTA (0.43) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL15298585 0.87 FNTA (0.42) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL23065653 0.81 ALDH1A1 (0.41) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL15298488 0.78 FNTA (0.46) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL23065722 0.76 ALDH1A1 (0.40) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL25531629 0.75 ALDH1A1 (0.39) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL12502178 0.74 ALDH1A1 (0.56) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL12502177 0.74 ALDH1A1 (0.56) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL13976153 0.72 FNTA (0.48) FNTAFNTBKMT2AALDH1A1MEN1
SCHEMBL13860827 0.72 APP (0.47) FNTAFNTBKMT2AALDH1A1MEN1

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-2012158250-A1 PLASTICIZERS Amyris, Inc. (US) 2012-11-22 WO disclosed