SCHEMBL4390600

SCHEMBL4390600

CC(=O)N1CCN(c2ccc(-c3cc(C(=O)NC[C@H]4CC[C@H](CNC(=O)O)CC4)c4ccccc4n3)cn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 13/20 0.53
ACACA Q13085 12/20 0.52
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
KDM4E B2RXH2 4/20 0.49
MAPK1 P28482 4/20 0.49
TSHR P16473 3/20 0.49
RCE1 Q9Y256 1/20 0.49
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
TP53 P04637 3/20 0.49
HSD17B10 Q99714 3/20 0.49
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
USP2 O75604 1/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 2/20 0.48

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
SCHEMBL4390608 1.00 ACACB (0.53) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL4012255 0.92 ACACB (0.55) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL4012250 0.92 ACACB (0.55) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL4394891 0.91 ACACB (0.55) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL4394883 0.91 ACACB (0.55) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL13590734 0.90 ACACB (0.70) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL4391594 0.89 ACACB (0.54) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL4391583 0.89 ACACB (0.54) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL4390241 0.88 ACACB (0.53) ACACBACACACYP1A2CYP3A4CYP2C9
SCHEMBL4396141 0.88 ACACB (0.60) ACACBACACACYP1A2CYP3A4CYP2C9

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-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ASTRAZENECA AB (SE) 2009-12-10 US claimed
US-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ASTRAZENECA AB (SE) 2009-12-10 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-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ACACA, ACACB, ACAT1 ACACB 2/4885ACACA 1/4885CYP1A2 903/4885

“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.