SCHEMBL9684398

SCHEMBL9684398

CC/C(C)=C\CC/C(=C/C[O])CC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.41
FNTB P49356 4/20 0.41
SQLE Q14534 3/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
UGT1A1 P22309 1/20 0.33
KDM4E B2RXH2 2/20 0.31
ATM Q13315 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL9684402 1.00 FNTA (0.41) FNTAFNTBSQLEKMT2AMAPT
SCHEMBL17220609 0.84 SQLE (0.43) FNTAFNTBSQLEKMT2AMAPT
SCHEMBL17220608 0.84 SQLE (0.43) FNTAFNTBSQLEKMT2AMAPT
SCHEMBL10663274 0.82 FNTA (0.40) FNTAFNTBSQLEKMT2AMAPT
SCHEMBL11280546 0.82 FNTA (0.40) FNTAFNTBSQLEKMT2AMAPT
Acetone SCHEMBL10663269 0.82 FNTA (0.40) FNTAFNTBSQLEKMT2AMAPT
SCHEMBL29788630 0.81 KMT2A (0.48) FNTAFNTBSQLEKMT2AMAPT
SCHEMBL27515965 0.81 FNTA (0.39) FNTAFNTBSQLEKMT2AMAPT
SCHEMBL11757320 0.81 KMT2A (0.48) FNTAFNTBSQLEKMT2AMAPT
SCHEMBL11757326 0.81 KMT2A (0.48) FNTAFNTBSQLEKMT2AMAPT

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
EP-0475158-A2 Use of alpha aryl acrylic acid derivatives for pest control BASF Aktiengesellschaft (DE) 1992-03-18 EP disclosed