SCHEMBL7101491

SCHEMBL7101491

Cc1cc(O)c(C(=O)OC(C)C2CC2)c(=O)o1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 12/20 0.43
KMT2A Q03164 12/20 0.43
RAB9A P51151 6/20 0.43
NPC1 O15118 3/20 0.43
ELANE P08246 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 2/20 0.41
PKM P14618 3/20 0.41
MAPT P10636 6/20 0.41
GAA P10253 4/20 0.41
KDM4E B2RXH2 3/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
ALDH1A1 P00352 3/20 0.40
USP2 O75604 2/20 0.40
PPARG P37231 1/20 0.40
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
PLIN1 O60240 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
SCHEMBL6027416 0.87 MEN1 (0.51) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL6026860 0.81 MEN1 (0.46) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL6026879 0.79 ELANE (0.50) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL6026922 0.78 ELANE (0.52) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL6027149 0.76 SERPINE1 (0.46) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL6027054 0.76 MEN1 (0.44) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL7965056 0.76 CYP3A4 (0.51) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL6027161 0.75 ELANE (0.46) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL6026095 0.74 ELANE (0.48) MEN1KMT2ARAB9ANPC1ELANE
SCHEMBL7225637 0.73 MEN1 (0.49) MEN1KMT2ARAB9ANPC1ELANE

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-2003099008-A1 USE OF PYRONE CARBOXYLATES FOR CONTROLLING PESTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-04 WO disclosed