SCHEMBL4680069

SCHEMBL4680069

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

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.38
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LIG1 P18858 1/20 0.32
MAPT P10636 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
SRC P12931 1/20 0.31
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
PKM P14618 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL4681122 0.89 CSNK2A1 (0.39) HPGDMEN1KMT2ALIG1GAA
SCHEMBL4683621 0.85 TSHR (0.32) LIG1MAPTGAATSHRCYP3A4
SCHEMBL4683581 0.82 FNTA (0.31)
SCHEMBL4686547 0.80 CYP3A4 (0.36) CYP3A4ALDH1A1
SCHEMBL4683499 0.78 DHODH (0.42) MEN1KMT2ATSHRKDM4EALDH1A1
SCHEMBL4686526 0.78 TSHR (0.32) LIG1MAPTGAATSHRCYP3A4
SCHEMBL4683650 0.75
SCHEMBL4684955 0.75 CXCR5 (0.36) HPGDMEN1KMT2ALIG1GAA
SCHEMBL4686490 0.75 TRPM4 (0.31)
SCHEMBL4681144 0.74 CYP3A4 (0.35) LIG1MAPTTSHRCYP3A4KDM4E

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 HPGD 2083/4885MEN1 2081/4885KMT2A 2939/4885

“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.