SCHEMBL8224724

SCHEMBL8224724

CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)N(c1ccc(-c3ccccc3)cc1)C2c1cccnc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
GPR119 Q8TDV5 4/20 0.50
TRPV1 Q8NER1 7/20 0.47
NAMPT P43490 1/20 0.45
GBA1 P04062 1/20 0.45
KDM1A O60341 1/20 0.45
USP30 Q70CQ3 1/20 0.45
NR1H2 P55055 3/20 0.41
RXRA P19793 2/20 0.41
NR1H3 Q13133 2/20 0.41
BACE1 P56817 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
SCHEMBL8218928 0.94 HDAC1 (0.56) HDAC1HDAC6GPR119TRPV1NAMPT
SCHEMBL8217835 0.91 TRPV1 (0.55) GPR119TRPV1USP30NR1H2RXRA
SCHEMBL8217952 0.90 HDAC1 (0.52) HDAC1HDAC6GPR119TRPV1NAMPT
SCHEMBL8214411 0.90 GPR119 (0.56) HDAC1HDAC6GPR119TRPV1NAMPT
SCHEMBL8217831 0.88 HDAC1 (0.53) HDAC1HDAC6GPR119TRPV1NAMPT
SCHEMBL8224617 0.85 HDAC1 (0.53) HDAC1HDAC6GPR119NAMPT
SCHEMBL8212694 0.84 TRPV1 (0.61) HDAC1HDAC6GPR119TRPV1USP30
SCHEMBL8217839 0.84 CACNA1H (0.49) TRPV1USP30
SCHEMBL8225731 0.83 CACNA1H (0.48) GPR119TRPV1USP30
SCHEMBL8207926 0.83 TRPV1 (0.51) HDAC1HDAC6GPR119TRPV1USP30

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
US-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof SCHERING CORPORATION 2008-03-27 US disclosed
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 HDAC1 937/4885HDAC6 2818/4885GPR119 81/4885

“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.