SCHEMBL8224619

SCHEMBL8224619

CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)N(c1cncnc1)C2c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 14/20 0.46
CYP3A4 P08684 1/20 0.44
CYP3A5 P20815 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.43
HPGD P15428 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
GPR119 Q8TDV5 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
SCHEMBL8207926 0.90 TRPV1 (0.51) CACNA1HHDAC1HDAC6GPR119
SCHEMBL8224778 0.90 GPR119 (0.52) CACNA1HCYP3A4CYP3A5HDAC1HDAC6
SCHEMBL14263432 0.87 CACNA1H (0.54) CACNA1HMEN1KMT2AGPR119
SCHEMBL8217831 0.85 HDAC1 (0.53) MEN1KMT2AHDAC1HDAC6GPR119
SCHEMBL8205482 0.85 CACNA1H (0.55) CACNA1H
SCHEMBL8218916 0.85 CACNA1H (0.57) CACNA1H
SCHEMBL8209853 0.83 TRPV1 (0.55) CACNA1HNPSR1GPR119
SCHEMBL8210218 0.83 CACNA1H (0.46) CACNA1HMEN1KMT2ANPSR1
SCHEMBL8217839 0.83 CACNA1H (0.49) CACNA1HMEN1KMT2A
SCHEMBL8210646 0.83 GPR119 (0.52) CACNA1HGPR119

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-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof SCHERING CORPORATION 2008-03-27 US disclosed
WO-2008033460-A2 TREATING PAIN, DIABETES, AND LIPID METABOLISM DISORDERS SCHERING CORPORATION (US) 2008-03-20 WO 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-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof LIPC, CES1, ZDHHC20 CACNA1H 2829/4885CYP3A4 119/4885CYP3A5 99/4885

“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.