SCHEMBL12432166

SCHEMBL12432166

CCNC(=O)Nc1sc2c(OC)cccc2c1C(=O)N1CCC2(CC1)N=C(COCC(C)C)NC2=O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACACB O00763 19/20 0.53
ACACA Q13085 19/20 0.53
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL12510672 0.90 ACACB (0.58) ACACBACACAKDM4ECYP1A2CYP3A4
SCHEMBL12432101 0.88 ACACB (0.56) ACACBACACAKDM4ECYP1A2CYP3A4
SCHEMBL12432163 0.88 ACACB (0.52) ACACBACACA
SCHEMBL12432147 0.87 ACACB (0.55) ACACBACACAKDM4ECYP1A2CYP3A4
SCHEMBL12432136 0.87 ACACB (0.56) ACACBACACAKDM4ECYP1A2CYP3A4
SCHEMBL12432168 0.86 ACACB (0.56) ACACBACACA
SCHEMBL2208717 0.85 ACACB (0.53) ACACBACACAKDM4ECYP1A2CYP3A4
SCHEMBL12432157 0.81 ACACB (0.52) ACACBACACA
SCHEMBL2208719 0.81 ACACB (0.49) ACACBACACAKDM4ECYP1A2CYP3A4
SCHEMBL2208181 0.80 ACACB (0.43) ACACBACACAKDM4ECYP1A2CYP3A4

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-7981904-B2 Acetyl CoA carboxylase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-07-19 US disclosed
US-7981904-B2 Acetyl CoA carboxylase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-07-19 US disclosed
US-20090253725-A1 ACETYL CoA CARBOXYLASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-08 US disclosed
US-20090253725-A1 ACETYL CoA CARBOXYLASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-08 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-20090253725-A1 ACETYL CoA CARBOXYLASE INHIBITORS ACACA, ACACB, ACAT1 ACACB 2/4885ACACA 1/4885KDM4E 1756/4885

“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.