SCHEMBL3210651

SCHEMBL3210651

CN(C)CCNC(=O)C1CC[CH]CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.46
HSD17B10 Q99714 1/20 0.43
TP53 P04637 3/20 0.42
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
THRB P10828 1/20 0.40
POLB P06746 2/20 0.39
LMNA P02545 2/20 0.39
NAAA Q02083 1/20 0.39
TSHR P16473 1/20 0.39
PKM P14618 1/20 0.38
KMT2A Q03164 1/20 0.38
GFER P55789 1/20 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
SCHEMBL3225092 0.92 HSD11B1 (0.47) HSD11B1L3MBTL1HSD17B10TP53ADORA2A
SCHEMBL3224121 0.84 L3MBTL1 (0.45) HSD11B1L3MBTL1HSD17B10TP53THRB
SCHEMBL9538617 0.84 NAAA (0.54) HSD11B1L3MBTL1HSD17B10TP53THRB
Hydrochloric Acid SCHEMBL21197531 0.82 NAAA (0.53) HSD11B1L3MBTL1HSD17B10TP53THRB
Hydrochloric Acid SCHEMBL21197517 0.82 L3MBTL1 (0.51) HSD11B1L3MBTL1HSD17B10TP53ADORA2A
SCHEMBL7260975 0.82 NAAA (0.57) HSD11B1L3MBTL1HSD17B10THRBPOLB
Hydrochloric Acid SCHEMBL21198744 0.81 NAAA (0.56) HSD11B1L3MBTL1HSD17B10THRBPOLB
SCHEMBL16727370 0.81 POLB (0.53) HSD11B1L3MBTL1HSD17B10TP53ADORA2A
SCHEMBL9795296 0.81 HSD11B1 (0.49) HSD11B1L3MBTL1HSD17B10TP53ADORA2A
SCHEMBL21860340 0.79 HSD11B1 (0.51) HSD11B1L3MBTL1HSD17B10TP53ADORA2A

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-20100063049-A1 2-CARBOCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2010-03-11 US disclosed
EP-2029578-A1 2-CARBOCYCLOAMINO-4-IMIDAZ0LYLPYRIMIDINES AS AGENTS FOR THE INHBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2009-03-04 EP disclosed
WO-2007138277-A1 2-CARBOCYCLOAMINO-4-IMIDAZ0LYLPYRIMIDINES AS AGENTS FOR THE INHBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2007-12-06 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-20100063049-A1 2-CARBOCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHBITION OF CELL PROLIFERATION MKI67, CCNI, CDK2 HSD11B1 3064/4885L3MBTL1 3470/4885HSD17B10 1580/4885

“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.