SCHEMBL18895983

SCHEMBL18895983

CC/C=C1\C2=CC=NC2COc2ccc(C(C)(C)O)cc21

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.32
▸ 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
SCHEMBL18895982 0.81 — —
SCHEMBL12121700 0.78 CYP19A1 (0.31) CYP19A1
SCHEMBL14420192 0.67 CCR1 (0.32) CCR1
SCHEMBL13824505 0.66 CCR1 (0.32) CCR1
SCHEMBL18633827 0.64 CCR1 (0.39) CCR1
SCHEMBL16312668 0.63 CCR1 (0.39) CCR1
SCHEMBL14579593 0.63 TBXA2R (0.31) CCR1
SCHEMBL15478381 0.61 CCR1 (0.38) CCR1
SCHEMBL436922 0.58 CCR1 (0.59) CCR1
SCHEMBL14579805 0.58 CCR1 (0.59) 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
US-9663537-B2 Chemokine receptor antagonists and methods of use MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-05-30 — — US disclosed
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