SCHEMBL9547670

SCHEMBL9547670

O=C(O)C(=O)C1CCCC1=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.48
CYP1A2 P05177 1/20 0.39
RECQL P46063 1/20 0.39
MAPK1 P28482 1/20 0.39
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
KMT2A Q03164 2/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
OPRK1 P41145 1/20 0.32
HTT P42858 1/20 0.32
CREBBP Q92793 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
OAT P04181 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
SCHEMBL10967147 0.93 MCL1 (0.56) MCL1CYP1A2RECQLMAPK1CA1
SCHEMBL932332 0.81
SCHEMBL22468834 0.81
SCHEMBL7614068 0.80 MCL1 (0.43) MCL1CYP1A2RECQLMAPK1CA1
Ethane SCHEMBL4051846 0.77 MCL1 (0.48) MCL1CYP1A2RECQLMAPK1CA1
Ethylene SCHEMBL10582422 0.77 MCL1 (0.48) MCL1CYP1A2RECQLMAPK1CA1
SCHEMBL31464263 0.76
SCHEMBL7614074 0.75 MAPK1 (0.45) MCL1CYP1A2RECQLMAPK1CA1
SCHEMBL11820915 0.74
SCHEMBL22020336 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5252596-A Insecticides, miticides, fungicides UBE INDUSTRIES, LTD. (JP) 1993-10-12 US disclosed
EP-0521409-A1 Phenoxyalkylamine derivative, method for preparing the same and chemical for controlling noxious organisms containing the same UBE INDUSTRIES, LTD. (JP) 1993-01-07 EP disclosed