SCHEMBL12121700

SCHEMBL12121700

CC/C=C1\C2=CC=CNC2COc2ccc(C(C)(C)O)cc21

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.31

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
SCHEMBL14420192 0.89 CCR1 (0.32) —
SCHEMBL13824505 0.86 CCR1 (0.32) —
SCHEMBL18633827 0.85 CCR1 (0.39) —
SCHEMBL14579593 0.83 TBXA2R (0.31) —
SCHEMBL18896005 0.79 CCR1 (0.33) —
SCHEMBL18895930 0.78 CCR1 (0.43) —
SCHEMBL18895983 0.78 CCR1 (0.32) CYP19A1
SCHEMBL15478420 0.78 CCR1 (0.37) —
SCHEMBL15478375 0.77 CCR1 (0.50) —
SCHEMBL15478377 0.77 CCR1 (0.39) —

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
US-8058287-B2 Chemokine receptor antagonists and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-11-15 — — US disclosed
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