SCHEMBL5465401

SCHEMBL5465401

CC(C)(C)OC(=O)N1CCc2[nH]nc(C(=O)NCC3CC3)c2C1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
NAMPT P43490 5/20 0.42
RBP4 P02753 3/20 0.42
CDK5 Q00535 2/20 0.41
CDK5R1 Q15078 2/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
PIK3CD O00329 1/20 0.39
GSK3B P49841 1/20 0.38
DRD2 P14416 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
FPR3 P25089 1/20 0.38
FPR2 P25090 1/20 0.38
ACKR3 P25106 1/20 0.37

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
SCHEMBL22482203 0.91 CDK5 (0.44) KDM4EPKMNAMPTRBP4CDK5
SCHEMBL17870544 0.84 RBP4 (0.40) KDM4EPKMNAMPTRBP4CDK5
SCHEMBL4795587 0.84 NPC1 (0.48) RBP4CDK5CDK5R1GAANPC1
SCHEMBL29386147 0.84 RBP4 (0.42) NAMPTRBP4GAA
SCHEMBL22482006 0.83 RBP4 (0.41) NAMPTRBP4CDK5CDK5R1GAA
SCHEMBL22029668 0.81 NAMPT (0.36) NAMPTRBP4CDK5CDK5R1GAA
SCHEMBL4792110 0.80 ADORA1 (0.46) RBP4
SCHEMBL14520683 0.80 ESR2 (0.41) RBP4
SCHEMBL2587065 0.80 KDM4E (0.47) KDM4EPKMNAMPTSMN1; SMN2PIK3CD
SCHEMBL25430237 0.79 ADORA1 (0.43) KDM4ENAMPTRBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070093515-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-04-26 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-20070093515-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE12, PDE10A KDM4E 1860/4885PKM 2417/4885NAMPT 616/4885

“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.