SCHEMBL2170449

SCHEMBL2170449

O=CCCc1cc(Br)no1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.32

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
SCHEMBL29663926 0.77 HPGD (0.30)
SCHEMBL20818866 0.77 VHL (0.42)
SCHEMBL18914637 0.77 CHRM1 (0.36) CHRM1
SCHEMBL8128659 0.75
SCHEMBL6768555 0.74 PPARA (0.34)
SCHEMBL6769135 0.74 NOTUM (0.58)
SCHEMBL10341846 0.74
SCHEMBL19916741 0.73 ALDH1A1 (0.37)
SCHEMBL4349489 0.72 PPARA (0.44) CHRM1
SCHEMBL6774196 0.72 RAB9A (0.48)

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-2346868-A1 AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-07-27 EP disclosed
WO-2010036632-A1 AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 WO disclosed