SCHEMBL6281452

SCHEMBL6281452

CC(C)(C)OC(=O)CN1CCN(c2cccc(N)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.49
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
TSHR P16473 2/20 0.44
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
GFER P55789 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GPR119 Q8TDV5 1/20 0.43
ATM Q13315 1/20 0.43
DRD4 P21917 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 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
SCHEMBL2648606 0.85 ADRA2C (0.53) ADRA2CMEN1KMT2ATSHRMAPT
SCHEMBL16824829 0.85 GFER (0.53) ADRA2CMEN1KMT2AMAPTALDH1A1
SCHEMBL17152957 0.84 ALDH1A1 (0.42) MEN1KMT2ATSHRALDH1A1SMN1; SMN2
SCHEMBL2661949 0.83 ADRA2C (0.50) ADRA2CMEN1KMT2ATSHRMAPT
SCHEMBL5783473 0.82 ENPP2 (0.51) MAPTALDH1A1SMN1; SMN2POLBLMNA
SCHEMBL27482946 0.82 SMN1; SMN2 (0.63) ADRA2CMEN1KMT2ATSHRMAPT
SCHEMBL18412523 0.81 CA12 (0.50) MEN1KMT2ATSHRALDH1A1SMN1; SMN2
SCHEMBL18412526 0.81 SIGMAR1 (0.53) TSHRMAPTALDH1A1SMN1; SMN2MAPK1
SCHEMBL30198151 0.80 GPR119 (0.60) ADRA2CMAPTALDH1A1GPR119LMNA
SCHEMBL265132 0.80 GPR119 (0.60) ADRA2CMAPTALDH1A1GPR119LMNA

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
US-6936613-B2 Benzimidazole derivatives and pharmaceutical compositions comprising these compounds NEUROSEARCH A/S (DK) 2005-08-30 US disclosed
US-20040097570-A1 Novel benzimidazole derivatives and pharmaceutical compositions comprising these compounds NEUROSEARCH A/S 2004-05-20 US disclosed
US-6649609-B2 For inducing and maintaining anesthesia, sedation and muscle relaxation, as well as for combating febrile convulsions in children NEUROSEARCH A/S (DK) 2003-11-18 US disclosed
US-20030055055-A1 Novel benzimidazole derivatives and pharmaceutical compositions comprising these compounds ANIONA APS (DK) 2003-03-20 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 (2 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-20040097570-A1 Novel benzimidazole derivatives and pharmaceutical compositions comprising these compounds GABRA1, GABRA2, GABRA4 ADRA2C 40/4885MEN1 4632/4885KMT2A 1116/4885
US-20030055055-A1 Novel benzimidazole derivatives and pharmaceutical compositions comprising these compounds GABRA1, GABRA2, GABRA4 ADRA2C 39/4885MEN1 4691/4885KMT2A 1597/4885

“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.