SCHEMBL1917883

SCHEMBL1917883

CN1CCN(Cc2ccccc2)C1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM6 O15303 1/20 0.43
POLB P06746 1/20 0.42
OPRD1 P41143 1/20 0.42
MC4R P32245 1/20 0.42
SIGMAR1 Q99720 3/20 0.42
MAPT P10636 1/20 0.42
S1PR1 P21453 1/20 0.42
S1PR5 Q9H228 1/20 0.42
HDAC4 P56524 1/20 0.41
KCNH2 Q12809 1/20 0.41
HDAC1 Q13547 1/20 0.41

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
SCHEMBL28979080 0.78 GRM6 (0.42) GRM6POLBSIGMAR1S1PR1S1PR5
SCHEMBL25195472 0.78 GRM6 (0.49) GRM6POLBSIGMAR1MAPTS1PR1
SCHEMBL1834264 0.76 ACHE (0.49) MC4RSIGMAR1MAPT
SCHEMBL11476458 0.75 SIGMAR1 (0.51) GRM6MC4RSIGMAR1MAPTS1PR1
SCHEMBL25154331 0.75 CHRM1 (0.42) POLBSIGMAR1MAPT
SCHEMBL25154443 0.75 CHRM1 (0.42) POLBSIGMAR1MAPT
SCHEMBL25154711 0.75 CHRM1 (0.42) POLBSIGMAR1MAPT
SCHEMBL25154567 0.75 CHRM1 (0.42) POLBSIGMAR1MAPT
SCHEMBL25154579 0.75 CHRM1 (0.42) POLBSIGMAR1MAPT
SCHEMBL25154702 0.75 CHRM1 (0.42) POLBSIGMAR1MAPT

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
US-9040653-B2 Ring-opening polymerization of cyclic compounds catalyzed by carbene derivatives NANJING UNIVERSITY OF TECHNOLOGY (CN) 2015-05-26 US disclosed
EP-2327736-B1 METHOD OF ADJUSTABLE AND CONTROLLABLE RING-OPENING POLYMERIZATION OF CYCLIC COMPOUNDS BY CATALYSIS OF CARBENE DERIVATIVES NANJING UNIVERSITY OF TECHNOLOGY (CN) 2015-03-18 EP disclosed
US-20110144296-A1 RING-OPENING POLYMERIZATION OF CYCLIC COMPOUNDS CATALYZED BY CARBENE DERIVATIVES NANJING UNIVERSITY OF TECHNOLOGY 2011-06-16 US disclosed
EP-2327736-A1 METHOD OF ADJUSTABLE AND CONTROLLABLE RING-OPENING POLYMERIZATION OF CYCLIC COMPOUNDS BY CATALYSIS OF CARBENE DERIVATIVES Nanjing University of Technology (CN) 2011-06-01 EP disclosed