SCHEMBL4203449

SCHEMBL4203449

N[C@H]1CC[C@@H](Cc2ccccc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.59
CCR3 P51677 3/20 0.53
PRMT3 O60678 1/20 0.53
CARM1 Q86X55 1/20 0.53
PRMT6 Q96LA8 1/20 0.53
PRMT1 Q99873 1/20 0.53
PRMT8 Q9NR22 1/20 0.53
SIGMAR1 Q99720 3/20 0.47
TMEM97 Q5BJF2 1/20 0.47
GRIN2B Q13224 2/20 0.47
MGLL Q99685 1/20 0.47
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL6160526 1.00 GBA1 (0.59) GBA1CCR3PRMT3CARM1PRMT6
Hydrochloric Acid SCHEMBL30304790 0.98 GBA1 (0.57) GBA1CCR3PRMT3CARM1PRMT6
Hydrochloric Acid SCHEMBL29210829 0.98 GBA1 (0.57) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL674276 0.89 GBA1 (0.71) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL2027845 0.89 GBA1 (0.71) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL13936369 0.88 GBA1 (0.50) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL3898572 0.88 GBA1 (0.50) GBA1CCR3PRMT3CARM1PRMT6
Ammonia Solution, Strong SCHEMBL1432566 0.86 GBA1 (0.68) GBA1CCR3PRMT3CARM1PRMT6
Hydrochloric Acid SCHEMBL4797146 0.84 GBA1 (0.65) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL5525774 0.83 GBA1 (0.59) GBA1CCR3PRMT3CARM1PRMT6

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
CN-103087066-A Haloaryl Substituted Aminopurines, Compositions Thereof, And Methods Of Treatment Therewith PHARMACOPEIA DRUG DISCOVERY 2013-05-08 CN disclosed
EP-2029578-A1 2-CARBOCYCLOAMINO-4-IMIDAZ0LYLPYRIMIDINES AS AGENTS FOR THE INHBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2009-03-04 EP disclosed
CN-101142215-A Haloaryl substituted aminopurines, compositions thereof, and methods of treatment therewith SIGNAL PHARM LLC (US) 2008-03-12 CN disclosed
WO-2007138277-A1 2-CARBOCYCLOAMINO-4-IMIDAZ0LYLPYRIMIDINES AS AGENTS FOR THE INHBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2007-12-06 WO disclosed