SCHEMBL3225092

SCHEMBL3225092

CN(C)CCNC(=O)C1C[CH]CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
HSD17B10 Q99714 1/20 0.39
TP53 P04637 3/20 0.39
POLB P06746 2/20 0.39
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
PKM P14618 1/20 0.37
THRB P10828 1/20 0.37
LMNA P02545 1/20 0.36
FPR3 P25089 3/20 0.36
FPR2 P25090 2/20 0.36
ALDH1A1 P00352 1/20 0.36
RECQL P46063 1/20 0.36
DNM1 Q05193 1/20 0.36

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
SCHEMBL3224121 0.92 L3MBTL1 (0.45) HSD11B1L3MBTL1HSD17B10TP53POLB
SCHEMBL3210651 0.92 HSD11B1 (0.51) HSD11B1L3MBTL1HSD17B10TP53POLB
SCHEMBL2537660 0.81 CHRNB2 (0.49) HSD17B10TP53POLBADORA1ALDH1A1
SCHEMBL9538617 0.79 NAAA (0.54) HSD11B1L3MBTL1HSD17B10TP53POLB
SCHEMBL7260975 0.77 NAAA (0.57) HSD11B1L3MBTL1HSD17B10POLBPKM
Hydrochloric Acid SCHEMBL21197517 0.77 L3MBTL1 (0.51) HSD11B1L3MBTL1HSD17B10TP53POLB
Hydrochloric Acid SCHEMBL21197531 0.77 NAAA (0.53) HSD11B1L3MBTL1HSD17B10TP53POLB
SCHEMBL2534227 0.77 EPHX1 (0.39) HSD17B10ALDH1A1
SCHEMBL15717383 0.77 EPHX1 (0.39) HSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL21198744 0.76 NAAA (0.56) HSD11B1L3MBTL1HSD17B10POLBPKM

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.