SCHEMBL11102484

SCHEMBL11102484

C=C(C)COC1=CCCCC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 2/20 0.37
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
MAPT P10636 3/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
GPR174 Q9BXC1 1/20 0.31
HIF1A Q16665 1/20 0.31
MEN1 O00255 1/20 0.31
PKM P14618 1/20 0.31
KMT2A Q03164 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
SCHEMBL3603099 0.77 GSTP1 (0.38) GSTP1ALDH1A1LMNATSHRMAPT
SCHEMBL24701459 0.76 GSTP1 (0.41) GSTP1
SCHEMBL11104225 0.72 PTPRC (0.38) GSTP1ALDH1A1MAPTTP53CYP3A4
SCHEMBL11336110 0.72 GSTP1 (0.36) GSTP1ALDH1A1LMNATSHRTP53
SCHEMBL16714050 0.72 GSTP1 (0.41) GSTP1ALDH1A1KDM4ELMNAHSD17B10
SCHEMBL1804084 0.70
SCHEMBL3369781 0.67 MAPT (0.37) GSTP1ALDH1A1MAPTTP53HIF1A
SCHEMBL616033 0.67 GSTP1 (0.42) GSTP1ALDH1A1TSHRHSD17B10HTT
SCHEMBL26987773 0.67 TP53 (0.39) GSTP1TSHRTP53SMN1; SMN2ALOX15
SCHEMBL5664113 0.67 CYP3A4 (0.56) ALDH1A1NPSR1HTTMAPTSMN1; SMN2

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
US-4463184-A Process for the preparation of carbofuran UNION CARBIDE CORPORATION (US) 1984-07-31 US claimed
EP-0107399-A1 Improved process for the preparation of carbofuran UNION CARBIDE CORPORATION (US) 1984-05-02 EP claimed
EP-0071487-A2 Improved process for the preparation of carbofuran and novel intermediate UNION CARBIDE CORPORATION (US) 1983-02-09 EP claimed
US-4463184-A Process for the preparation of carbofuran UNION CARBIDE CORPORATION (US) 1984-07-31 US disclosed
EP-0107399-A1 Improved process for the preparation of carbofuran UNION CARBIDE CORPORATION (US) 1984-05-02 EP disclosed
EP-0071487-A2 Improved process for the preparation of carbofuran and novel intermediate UNION CARBIDE CORPORATION (US) 1983-02-09 EP disclosed
EP-0071487-A2 Improved process for the preparation of carbofuran and novel intermediate UNION CARBIDE CORPORATION (US) 1983-02-09 EP disclosed