SCHEMBL1620131

SCHEMBL1620131

CC(=O)OC(C)/C=C/c1cnc(Oc2ccc(OC(C)C)cc2)s1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 20/20 0.72
ACACA Q13085 6/20 0.72
CYP2C9 P11712 4/20 0.72
CYP2C19 P33261 2/20 0.68

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
SCHEMBL1620134 1.00 ACACB (0.72) ACACBACACACYP2C9CYP2C19
SCHEMBL1619805 0.84 ACACB (0.70) ACACBACACACYP2C9CYP2C19
SCHEMBL1619812 0.84 ACACB (0.70) ACACBACACACYP2C9CYP2C19
SCHEMBL1619864 0.84 ACACB (1.00) ACACBACACACYP2C9CYP2C19
SCHEMBL1619861 0.84 ACACB (1.00) ACACBACACACYP2C9CYP2C19
SCHEMBL1619743 0.84 ACACB (0.69) ACACBACACACYP2C9CYP2C19
SCHEMBL1619741 0.84 ACACB (0.69) ACACBACACACYP2C9CYP2C19
SCHEMBL17050685 0.82 ACACB (0.66) ACACBACACACYP2C9CYP2C19
SCHEMBL17050686 0.81 ACACB (1.00) ACACBACACACYP2C9CYP2C19
SCHEMBL5423741 0.79 ACACB (0.61) ACACBACACACYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928243-B2 e.g. N-{(2Z)-3-[4-(4-isopropoxyphenoxy)phenyl]-1-methylprop-2-enyl}acetamide; antidiabetic agent; type II diabetes, atherosclerosis and cardiovascular diseases ABBOTT LABORATORIES (US) 2011-04-19 US disclosed
US-20080161368-A1 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ABBVIE INC. 2008-07-03 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-20080161368-A1 NOVEL ACETYL-COA CARBOXYLASE (ACC) INHIBITORS AND THEIR USE IN DIABETES, OBESITY AND METABOLIC SYNDROME ACACA, ACACB, ACAT1 ACACB 2/4885ACACA 1/4885CYP2C9 674/4885

“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.