SCHEMBL6350309

SCHEMBL6350309

CC(C)(C)OC(=O)N1CCCN(c2ccc(Cl)nc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
MAPT P10636 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
CKS1B P61024 2/20 0.53
SKP1 P63208 2/20 0.53
SKP2 Q13309 2/20 0.53
TSHR P16473 1/20 0.53
AKR1C3 P42330 1/20 0.53
GPR119 Q8TDV5 4/20 0.53
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
HTT P42858 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
POLB P06746 1/20 0.47
CCNK O75909 1/20 0.47
CCNA2 P20248 1/20 0.47
CDK2 P24941 1/20 0.47
CCND3 P30281 1/20 0.47
CDK9 P50750 1/20 0.47

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
SCHEMBL29361285 0.95 MAPT (0.57) MEN1KMT2AMAPTSMN1; SMN2CKS1B
SCHEMBL1115181 0.95 MAPT (0.57) MEN1KMT2AMAPTSMN1; SMN2CKS1B
SCHEMBL6352769 0.86 CKS1B (0.59) MEN1KMT2AMAPTSMN1; SMN2CKS1B
SCHEMBL30316131 0.86 CKS1B (0.53) MEN1KMT2AMAPTSMN1; SMN2CKS1B
SCHEMBL1990159 0.86 CKS1B (0.53) MEN1KMT2AMAPTSMN1; SMN2CKS1B
SCHEMBL6358835 0.86 CKS1B (0.53) MEN1KMT2AMAPTSMN1; SMN2CKS1B
SCHEMBL6356496 0.85 GPR119 (0.59) MEN1KMT2AMAPTSMN1; SMN2CKS1B
SCHEMBL27203534 0.84 SMN1; SMN2 (0.60) MEN1KMT2AMAPTSMN1; SMN2CKS1B
SCHEMBL1257264 0.84 MEN1 (0.70) MEN1KMT2AMAPTSMN1; SMN2TSHR
SCHEMBL25322081 0.83 CKS1B (0.55) MEN1KMT2AMAPTSMN1; SMN2CKS1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6897219-B2 Heteroaryl diazacycloalkanes, their preparation and use NEUROSEARCH A/S (DK) 2005-05-24 US disclosed
US-6825189-B1 TREATING WITHDRAWAL SYMPTOMS CAUSED BY SMOKING CESSATION NEUROSEARCH A/S (DK) 2004-11-30 US disclosed
EP-1027336-B1 HETEROARYL DIAZACYCLOALKANES AS CHOLINERGIC LIGANDS AT NICOTINIC ACETYLCHOLINE RECEPTORS NEUROSEARCH AS (DK) 2004-10-06 EP disclosed
US-20040072823-A1 Heteroaryl diazacycloalkanes, their preparation and use; NEUROSEARCH A/S 2004-04-15 US disclosed
EP-1027336-A1 HETEROARYL DIAZACYCLOALKANES AS CHOLINERGIC LIGANDS AT NICOTINIC ACETYLCHOLINE RECEPTORS NEUROSEARCH A/S (DK) 2000-08-16 EP disclosed
WO-1999021834-A1 HETEROARYL DIAZACYCLOALKANES AS CHOLINERGIC LIGANDS AT NICOTINIC ACETYLCHOLINE RECEPTORS NEUROSEARCH A/S (DK) 1999-05-06 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-20040072823-A1 Heteroaryl diazacycloalkanes, their preparation and use; OGFR, CBR3, OGFRL1 MEN1 1766/4885KMT2A 3835/4885MAPT 4539/4885

“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.