SCHEMBL6160522

SCHEMBL6160522

[NH]C1CCC(Cc2ccccc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.59
CCR3 P51677 2/20 0.53
SLC18A3 Q16572 1/20 0.49
PRMT3 O60678 1/20 0.49
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
PRMT1 Q99873 1/20 0.49
PRMT8 Q9NR22 1/20 0.49
GRIN2B Q13224 1/20 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
SCHEMBL8595149 1.00 GBA1 (0.59) GBA1CCR3SLC18A3PRMT3CARM1
SCHEMBL674276 0.89 GBA1 (0.71) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL2027845 0.89 GBA1 (0.71) GBA1CCR3PRMT3CARM1PRMT6
Ammonia Solution, Strong SCHEMBL1432566 0.86 GBA1 (0.68) GBA1CCR3PRMT3CARM1PRMT6
Hydrochloric Acid SCHEMBL4797146 0.84 GBA1 (0.65) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL10523879 0.83 GBA1 (0.59) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL8701 0.79 GBA1 (0.65) GBA1CCR3SLC18A3PRMT3CARM1
SCHEMBL316482 0.79 GBA1 (0.65) GBA1CCR3SLC18A3PRMT3CARM1
SCHEMBL6977373 0.78 GBA1 (0.59) GBA1CCR3SLC18A3PRMT3CARM1
SCHEMBL595263 0.78 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0939632-B1 NON-PEPTIDYL VASOPRESSIN V1a ANTAGONISTS LILLY CO ELI (US) 2005-10-05 EP disclosed
US-6610680-B1 Administering as adjuncts in heart failure or as antithrombotic agents, treatment of obsessive-compulsive disorder, aggressive disorders, depression and anxiety ELI LILLY AND COMPANY 2003-08-26 US disclosed
US-6521611-B2 2-(azetidin-2-on-1-yl) acetic acid derivatives; treatment of obsessive-compulsive disorder ELI LILLY AND COMPANY 2003-02-18 US disclosed
US-6204260-B1 2-(AZETIDIN-2-ON-1-YL)ACETIC ACID DERIVATIVES ELI LILLY AND COMPANY 2001-03-20 US disclosed
US-5852023-A Cyclohexylamino and cycloalkoxy nitrogen heterocycles, processes for their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1998-12-22 US disclosed
EP-0817774-A1 CYCLOHEXYLAMINO AND CYCLOHEXYLALKOXY NITROGEN HETEROCYCLES, METHODS OF PREPARING THEM AND THEIR USE AS PEST-CONTROL AGENTS AND FUNGICIDES Hoechst Schering AgrEvo GmbH (DE) 1998-01-14 EP disclosed
WO-1996030345-A1 CYCLOHEXYLAMINO AND CYCLOHEXYLALKOXY NITROGEN HETEROCYCLES, METHODS OF PREPARING THEM AND THEIR USE AS PEST-CONTROL AGENTS AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1996-10-03 WO disclosed