SCHEMBL8272245

SCHEMBL8272245

CC(C)(C)OC(=O)N[C@H]1CCN(c2noc(-c3ccccc3)n2)C1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 2/20 0.56
▸ SKP1 P63208 2/20 0.56
▸ SKP2 Q13309 2/20 0.56
▸ PDE10A Q9Y233 3/20 0.47
▸ ACKR3 P25106 1/20 0.47
▸ BTK Q06187 2/20 0.47
▸ PIM1 P11309 1/20 0.47
▸ PIM3 Q86V86 1/20 0.47
▸ PIM2 Q9P1W9 1/20 0.47
▸ USP30 Q70CQ3 2/20 0.44
▸ BRD4 O60885 1/20 0.44
▸ SUV39H2 Q9H5I1 1/20 0.44
▸ KCNA3 P22001 1/20 0.43
▸ MAP4K4 O95819 2/20 0.42
▸ CTSK P43235 2/20 0.42
▸ OPRM1 P35372 1/20 0.42
▸ OPRD1 P41143 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ OGFRL1 Q5TC84 1/20 0.42

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
SCHEMBL14375423 1.00 CKS1B (0.56) CKS1BSKP1SKP2PDE10AACKR3
SCHEMBL4213876 0.85 ACKR3 (0.53) CKS1BSKP1SKP2ACKR3USP30
SCHEMBL14375996 0.82 CKS1B (0.56) CKS1BSKP1SKP2PDE10ABTK
SCHEMBL14349357 0.82 CKS1B (0.56) CKS1BSKP1SKP2PDE10ABTK
SCHEMBL13793915 0.78 PDE10A (0.56) CKS1BSKP1SKP2PDE10ABTK
SCHEMBL23500781 0.78 CKS1B (0.56) CKS1BSKP1SKP2PDE10ABTK
SCHEMBL15222937 0.78 CKS1B (0.56) CKS1BSKP1SKP2PDE10ABTK
SCHEMBL18239342 0.77 GPR119 (0.55) CKS1BSKP1SKP2PDE10ABTK
SCHEMBL8271710 0.77 ACKR3 (0.41) ACKR3USP30OPRK1
SCHEMBL14349272 0.77 ACKR3 (0.43) CKS1BSKP1SKP2ACKR3USP30

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-20070293515-A1 1,3-Disubstituted Heteroaryl Nmda/Nr2b Antagonists MERCK SHARP & DOHME CORP. 2007-12-20 — — US disclosed
US-20070293515-A1 1,3-Disubstituted Heteroaryl Nmda/Nr2b Antagonists MERCK SHARP & DOHME CORP. 2007-12-20 — — US disclosed
WO-2006017409-A2 1,3-DISUBSTITUTED HETEROARYL NMDA/NR2B ANTAGONISTS MERCK & CO., INC. (US) 2006-02-16 — — 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-20070293515-A1 1,3-Disubstituted Heteroaryl Nmda/Nr2b Antagonists GRIN2B, GRIN2A, GRIN1 CKS1B 634/4885SKP1 473/4885SKP2 255/4885

“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.

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