SCHEMBL4651286

SCHEMBL4651286

Cc1ccc(Cl)c(-c2ccc(CN3CCNCC3Cc3ccccc3)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 6/20 0.50
▸ SLC6A4 P31645 6/20 0.50
▸ SLC6A3 Q01959 6/20 0.50
▸ CNR2 P34972 1/20 0.48
▸ MITF O75030 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL4649567 0.87 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CNR2MITF
SCHEMBL1415727 0.80 SLC6A2 (0.63) SLC6A2SLC6A4SLC6A3MITFTDP1
SCHEMBL27505917 0.80 SLC6A2 (0.63) SLC6A2SLC6A4SLC6A3MITFTDP1
SCHEMBL6936570 0.80 SLC6A2 (0.63) SLC6A2SLC6A4SLC6A3MITFTDP1
SCHEMBL15901735 0.78 CHIT1 (0.43) SLC6A2SLC6A4SLC6A3MITFTDP1
SCHEMBL15901734 0.78 CHIT1 (0.43) SLC6A2SLC6A4SLC6A3MITFTDP1
SCHEMBL4473540 0.76 CNR2 (0.57) CNR2
SCHEMBL4473536 0.76 CNR2 (0.57) CNR2
SCHEMBL4461953 0.76 CNR2 (0.59) CNR2
SCHEMBL4651287 0.76 CNR2 (0.64) CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966132-A2 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-09-10 — — EP disclosed
WO-2007070760-A2 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-21 — — WO disclosed
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