SCHEMBL4681122

SCHEMBL4681122

C=CCOP(=O)(OCC=C)OCc1ccc(C)cc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.39
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.36
GFER P55789 1/20 0.36
KMT2A Q03164 1/20 0.36
HPGD P15428 1/20 0.36
SRC P12931 2/20 0.34
CYP3A4 P08684 1/20 0.34
PLK1 P53350 6/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PLK3 Q9H4B4 1/20 0.33
PTPN1 P18031 1/20 0.32
LIG1 P18858 1/20 0.32

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
SCHEMBL4680069 0.89 HPGD (0.38) GAATSHRMEN1KMT2AHPGD
SCHEMBL4683622 0.85 KEAP1 (0.38) GAATSHRHPGDCYP3A4PKM
SCHEMBL4681323 0.81 GAA (0.34) GAATSHRCYP3A4PKMSMN1; SMN2
SCHEMBL6796887 0.81 CYP3A4 (0.44) GAATSHRKMT2AHPGDCYP3A4
SCHEMBL4680633 0.80 CYP3A4 (0.37) GAATSHRCYP3A4PKMSMN1; SMN2
SCHEMBL4683499 0.79 DHODH (0.42) TSHRMEN1KMT2ASMN1; SMN2
SCHEMBL4680325 0.77 TSHR (0.36) GAATSHRHPGDCYP3A4PKM
SCHEMBL4683704 0.75 GAA (0.33) GAATSHRCYP3A4PKMSMN1; SMN2
SCHEMBL4679839 0.74 CXCR5 (0.39) GAATSHRMEN1KMT2AHPGD
SCHEMBL4686723 0.74 TRPM4 (0.36) GAATSHRPKMSMN1; SMN2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1362856-B1 WATER-SOLUBLE TRIAZOLE FUNGICIDE DAIICHI SANKYO CO LTD (JP) 2008-09-10 EP disclosed
US-7230023-B2 Water-soluble triazole fungicide SANKYO COMPANY, LIMITED (JP) 2007-06-12 US disclosed
US-20040198790-A1 Water-soluble triazole fungicide SANKYO COMPANY, LIMITED (JP) 2004-10-07 US disclosed
EP-1362856-A1 WATER-SOLUBLE TRIAZOLE FUNGICIDE Sankyo Company, Limited (JP) 2003-11-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040198790-A1 Water-soluble triazole fungicide ERG28, CYP51A1, XDH CSNK2A1 3718/4885GAA 580/4885TSHR 2685/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.