SCHEMBL6913728

SCHEMBL6913728

CC(C=O)=CCc1ccco1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
POLB P06746 5/20 0.41
ATM Q13315 1/20 0.41
TSHR P16473 2/20 0.40
RAB9A P51151 1/20 0.39
RIPK1 Q13546 1/20 0.39
ALOX5 P09917 1/20 0.38
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.37
CHRM2 P08172 1/20 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
SCHEMBL20446691 0.81 ALDH1A1 (0.47) ALDH1A1POLBTSHRRAB9AALOX5
SCHEMBL28578731 0.79 ALDH1A1 (0.40) ALDH1A1POLBATMTSHRRAB9A
SCHEMBL151791 0.77 ALDH1A1 (0.49) ALDH1A1POLBATMTSHRRAB9A
SCHEMBL466030 0.77 ALDH1A1 (0.49) ALDH1A1POLBATMTSHRRAB9A
SCHEMBL28206057 0.76 ALDH1A1 (0.47) ALDH1A1POLBATMTSHRRAB9A
SCHEMBL553428 0.76 ALDH1A1 (0.47) ALDH1A1POLBTSHRRAB9ARIPK1
SCHEMBL553426 0.76 ALDH1A1 (0.47) ALDH1A1POLBTSHRRAB9ARIPK1
SCHEMBL15942168 0.75 TSHR (0.41) ALDH1A1POLBTSHRRAB9AALOX5
SCHEMBL28304781 0.75 TSHR (0.40) ALDH1A1POLBTSHRRAB9AKMT2A
SCHEMBL571231 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004002224-A1 COMPOSITION FOR INHIBITING GNAWING AND FEEDING BY INSECTS AND ANIMALS INTENDED TO BE APPLIED ON SEEDLINGS AND TREES FORSKARPATENT I SYD AB (SE) 2004-01-08 WO claimed
EP-1294229-A1 COMPOSITION FOR INHIBITING FEEDING OF WEEVILS Forskarpatent I SYD (SE) 2003-03-26 EP claimed
WO-2002000022-A1 COMPOSITION FOR INHIBITING FEEDING OF WEEVILS FORSKARPATENT I SYD (SE) 2002-01-03 WO claimed
CN-112566675-A Freshening compositions comprising controlled release modulators 阿里莱森斯有限公司 2021-03-26 CN disclosed
CN-104650015-B A kind of method that furyl aldehyde is prepared using efficiently catalyzing and oxidizing furfural and fatty alcohol 天津理工大学 2018-04-03 CN disclosed
EP-1294229-A1 COMPOSITION FOR INHIBITING FEEDING OF WEEVILS Forskarpatent I SYD (SE) 2003-03-26 EP disclosed
WO-2002000022-A1 COMPOSITION FOR INHIBITING FEEDING OF WEEVILS FORSKARPATENT I SYD (SE) 2002-01-03 WO disclosed