SCHEMBL13621676

SCHEMBL13621676

C=C(NCc1ccccc1CC)c1cccc2c1cnn2-c1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 17/20 0.61
▸ NR3C1 P04150 3/20 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
SCHEMBL13622320 0.88 CCR1 (0.61) CCR1
SCHEMBL13621675 0.88 CCR1 (0.59) CCR1
SCHEMBL13621725 0.80 CCR1 (0.61) CCR1
SCHEMBL13622321 0.80 CCR1 (0.61) CCR1
SCHEMBL13621892 0.80 CCR1 (0.63) CCR1
SCHEMBL13621908 0.79 CCR1 (0.61) CCR1
SCHEMBL13621723 0.79 CCR1 (0.59) CCR1
SCHEMBL13621761 0.78 CCR1 (0.58) CCR1
SCHEMBL1135701 0.78 CCR1 (0.73) CCR1
SCHEMBL1135853 0.78 CCR1 (0.75) CCR1

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-2009134666-A1 INDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-05 — — WO disclosed
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