SCHEMBL6201686

SCHEMBL6201686

CC(C)(C)OC(=O)N1CC2CC(C1)CN(c1ccc(Cl)nn1)C2

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
MEN1 O00255 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 2/20 0.42
HTT P42858 1/20 0.42
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
TRPV1 Q8NER1 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GPR119 Q8TDV5 3/20 0.39
PDE10A Q9Y233 2/20 0.39
NR1H2 P55055 1/20 0.39
PANK3 Q9H999 2/20 0.38

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
SCHEMBL29998990 0.88 PDE10A (0.48) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL15476104 0.88 PDE10A (0.48) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL928411 0.88 PDE10A (0.48) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL2333928 0.85 KMT2A (0.50) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL1433407 0.81 TRPV1 (0.57) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL30778281 0.81 TRPV1 (0.57) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL25182135 0.81 KMT2A (0.50) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL31104968 0.81 KMT2A (0.50) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL6735301 0.80 GPR119 (0.42) KMT2AMEN1KDM4EGPR119PDE10A
SCHEMBL23603467 0.79 CNR1 (0.47) KMT2AMEN1SMN1; SMN2LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1397365-B1 HETEROARYL-DIAZABICYCLO-ALKANES AS CNS-MODULATORS NEUROSEARCH AS (DK) 2005-02-16 EP disclosed
US-20040147505-A1 Novel heteroaryl-diazabicyclo alkanes as cns-modulators NEUROSEARCH A/S (DK) 2004-07-29 US disclosed
EP-1397365-A1 NOVEL HETEROARYL-DIAZABICYCLO-ALKANES AS CNS-MODULATORS NeuroSearch A/S (DK) 2004-03-17 EP disclosed
WO-2002096911-A1 NOVEL HETEROARYL-DIAZABICYCLO-ALKANES AS CNS-MODULATORS NEUROSEARCH A/S (DK) 2002-12-05 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-20040147505-A1 Novel heteroaryl-diazabicyclo alkanes as cns-modulators CHRNA3, CHRNA5, CHRNA2 KMT2A 2597/4885MEN1 4197/4885SMN1; SMN2 296/4885

“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.