SCHEMBL12502148

SCHEMBL12502148

CC(C)=CCC/C(C)=C/CCC1=CCCC(C=O)C1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.55
FNTB P49356 1/20 0.55
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 3/20 0.43
PKM P14618 1/20 0.43
PGGT1B P53609 1/20 0.43
PTPN1 P18031 2/20 0.42
PRKCG P05129 1/20 0.42
MAPT P10636 2/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
UGT1A1 P22309 1/20 0.41
PLA2G2A P14555 1/20 0.39
BCL2L1 Q07817 2/20 0.39
MCL1 Q07820 2/20 0.39
NR1H4 Q96RI1 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL12502150 1.00 FNTA (0.55) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL29626005 0.92 MEN1 (0.50) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL21986508 0.92 MEN1 (0.50) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL717922 0.92 MEN1 (0.50) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL13976292 0.88 FNTA (0.42) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL24183154 0.83 FNTA (0.55) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL24183215 0.81 FNTA (0.54) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL24183226 0.81 FNTA (0.53) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL10812462 0.81 FNTA (0.56) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL10812465 0.81 FNTA (0.56) FNTAFNTBKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022011031-A1 VACCINE ADJUVANTS AND METHODS OF SYNTHESIZING AND USING THE SAME Amyris, Inc. (US) 2022-01-13 WO disclosed
WO-2013028307-A1 DERIVATIVES OF HYDROCARBON TERPENES Amyris, Inc. (US) 2013-02-28 WO disclosed
WO-2013028307-A1 DERIVATIVES OF HYDROCARBON TERPENES Amyris, Inc. (US) 2013-02-28 WO disclosed
WO-2012158250-A1 PLASTICIZERS Amyris, Inc. (US) 2012-11-22 WO disclosed
WO-2012158250-A1 PLASTICIZERS Amyris, Inc. (US) 2012-11-22 WO disclosed
WO-2012103156-A1 SURFACTANTS Amyris, Inc. (US) 2012-08-02 WO disclosed