SCHEMBL4690150

SCHEMBL4690150

CC(C)(C)OC(=O)N1CCN(c2cccc(-c3ccncc3Cl)n2)CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.48
SKP1 P63208 2/20 0.48
SKP2 Q13309 2/20 0.48
SUV39H2 Q9H5I1 2/20 0.48
GPR119 Q8TDV5 9/20 0.45
GBA1 P04062 1/20 0.45
MAP4K4 O95819 1/20 0.45
POLB P06746 1/20 0.44
CCNT1 O60563 1/20 0.43
CCNK O75909 1/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
CCND3 P30281 1/20 0.43
CDK9 P50750 1/20 0.43
CDK6 Q00534 1/20 0.43
RET P07949 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
SCHEMBL5519622 0.82 CKS1B (0.49) CKS1BSKP1SKP2SUV39H2GPR119
SCHEMBL1907903 0.80 GPR119 (0.55) CKS1BSKP1SKP2GPR119GBA1
SCHEMBL29157432 0.80 CKS1B (0.53) CKS1BSKP1SKP2SUV39H2GPR119
SCHEMBL461584 0.80 CKS1B (0.62) CKS1BSKP1SKP2SUV39H2GPR119
SCHEMBL22391574 0.79 CKS1B (0.56) CKS1BSKP1SKP2SUV39H2GPR119
SCHEMBL1580206 0.78 CKS1B (0.52) CKS1BSKP1SKP2SUV39H2GPR119
SCHEMBL14545490 0.78 CKS1B (0.48) CKS1BSKP1SKP2SUV39H2GPR119
SCHEMBL13028209 0.78 BACE1 (0.50) CKS1BSKP1SKP2
SCHEMBL3275117 0.78 CKS1B (0.65) CKS1BSKP1SKP2GPR119GBA1
SCHEMBL3268524 0.78 CKS1B (0.48) CKS1BSKP1SKP2SUV39H2GPR119

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
EP-1871762-A2 SUBTITUTED HETEROARYL CB1 ANTAGONISTS NEUROGEN CORPORATION (US) 2008-01-02 EP disclosed
US-20070078135-A1 Substituted heteroaryl CB1 antagonists NEUROGEN CORPORATION (US) 2007-04-05 US disclosed
WO-2006113704-A2 SUBTITUTED HETEROARYL CB1 ANTAGONISTS NEUROGEN CORPORATION (US) 2006-10-26 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-20070078135-A1 Substituted heteroaryl CB1 antagonists CNR1, CNR2, OPRL1 CKS1B 1836/4885SKP1 3576/4885SKP2 4014/4885

“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.