SCHEMBL4495124

SCHEMBL4495124

C=C(C(=O)Oc1ccc(Cl)cc1)C(O)c1nccs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
CTSA P10619 2/20 0.39
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
HTT P42858 2/20 0.36
MAPT P10636 2/20 0.36
CASP3 P42574 2/20 0.36
SENP8 Q96LD8 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
SENP6 Q9GZR1 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
FFAR2 O15552 8/20 0.36
HSD17B10 Q99714 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
RBBP9 O75884 1/20 0.35

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
SCHEMBL4494328 0.87 TRPM8 (0.39) LMNACTSAMEN1KMT2ASMN1; SMN2
SCHEMBL4489781 0.87 NPC1 (0.43) LMNACTSAMEN1KMT2AMAPT
SCHEMBL4497712 0.87 RAB9A (0.41) CTSAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL4487757 0.86 MAPT (0.38) LMNACTSAMAPTCYP1A2CYP2C9
SCHEMBL4500155 0.85 CTSA (0.44) LMNACTSAMEN1KMT2AMAPT
SCHEMBL4493455 0.85 NPC1 (0.39) CTSASMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL4506051 0.84 CTSA (0.37) CTSASMN1; SMN2RAB9ANPC1
SCHEMBL4495117 0.84 CTSA (0.40) LMNACTSAMEN1KMT2AMAPT
SCHEMBL4487148 0.84 CTSA (0.42) LMNACTSAMEN1KMT2AMAPT
SCHEMBL4493907 0.83 CHRNA3 (0.37) CTSA

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
US-7541472-B2 3-Aryl-3-hydroxy-2-methylenepropionic acid esters as fungicides CROPSOLUTION, INC. (US) 2009-06-02 US disclosed
US-7541472-B2 3-Aryl-3-hydroxy-2-methylenepropionic acid esters as fungicides CROPSOLUTION, INC. (US) 2009-06-02 US disclosed
US-7541472-B2 3-Aryl-3-hydroxy-2-methylenepropionic acid esters as fungicides CROPSOLUTION, INC. (US) 2009-06-02 US disclosed
US-20060094739-A1 3-Aryl-3-hydroxy-2-methylenepropionic acid esters as fungicides ATP CAPITAL LP 2006-05-04 US 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-20060094739-A1 3-Aryl-3-hydroxy-2-methylenepropionic acid esters as fungicides CYP51A1, DDT, CYP21A2 LMNA 2062/4885CTSA 1423/4885MEN1 722/4885

“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.