SCHEMBL25513993

SCHEMBL25513993

CC(=O)c1nn(-c2ccc(C)cc2C)c(-c2ccc(C)cc2)c1C

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.46
CNR1 P21554 5/20 0.46
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL12907742 0.82 CNR2 (0.69) CNR2CNR1
SCHEMBL13532091 0.81 CNR1 (0.48) CNR2CNR1
SCHEMBL24208982 0.78 CNR1 (0.56) CNR2CNR1
SCHEMBL6173947 0.76 CNR2 (0.76) CNR2CNR1
SCHEMBL12918536 0.76 CNR1 (0.54) CNR2CNR1KDM4E
SCHEMBL13437230 0.76 KDM4E (0.44) CNR2CNR1KDM4E
SCHEMBL10140846 0.75 GRM5 (0.56) CNR1
SCHEMBL276982 0.74 KDM4E (0.43) CNR2CNR1KDM4E
SCHEMBL13437233 0.72 CNR1 (0.39) CNR2CNR1
SCHEMBL22244945 0.72 CNR2 (0.61) CNR2CNR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023089612-A1 PERIPHERAL CB1 RECEPTOR ANTAGONISTS FOR TREATMENT OF LOWER URINARY TRACT SYMPTOMS (LUTS) YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2023-05-25 WO disclosed