SCHEMBL6741501

SCHEMBL6741501

O=CC(=O)Oc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.47
CYP11B2 P19099 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 2/20 0.47
PPARA Q07869 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
ELANE P08246 1/20 0.46
LIPE Q05469 4/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
HTT P42858 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
BCHE P06276 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL9860326 0.84 CYP11B1 (0.49) CYP11B1CYP11B2MEN1KMT2AMAPT
SCHEMBL476290 0.80 THRB (0.55) CYP11B1CYP11B2MEN1KMT2AMAPT
SCHEMBL8858845 0.79 KMT2A (0.46) MEN1KMT2AMAPTELANEHTT
SCHEMBL56865 0.78 KMT2A (0.50) CYP11B1CYP11B2MEN1KMT2AMAPT
SCHEMBL7063178 0.78 ELANE (0.50) CYP11B1CYP11B2MEN1KMT2AMAPT
SCHEMBL2129488 0.77 LMNA (0.61) MEN1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL28744273 0.77 LDHA (0.45) MEN1KMT2AMAPTCES2CES1
SCHEMBL3976540 0.77 KMT2A (0.50) MEN1KMT2ACYP1A2HPGDSMN1; SMN2
SCHEMBL11291636 0.77 ELANE (0.46) MEN1KMT2AMAPTELANEHTT
SCHEMBL5177154 0.77 CYP11B1 (0.47) CYP11B1CYP11B2MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117265554-A Method for preparing thioester derivative by electrocatalytic reaction 江苏中利集团股份有限公司 2023-12-22 CN disclosed
US-6696607-B2 FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2004-02-24 US disclosed
US-20030191190-A1 Use of phenethyl acrylamides, novel phenethyl acrylamides, method for the production thereof and agents containing the same BASF AKTIENGESELLSCHAFT (DE) 2003-10-09 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-20030191190-A1 Use of phenethyl acrylamides, novel phenethyl acrylamides, method for the production thereof and agents containing the same CCR6, CCR3, CCR1 CYP11B1 1316/4885CYP11B2 1797/4885MEN1 4269/4885

“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.