SCHEMBL18895929

SCHEMBL18895929

CCN(CC/C=C1\C2=C(COc3ccc(C(C)(C)O)cc31)NCC=C2)CCC(CO)(N=[N+]=[N-])c1ccc(Cl)cc1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.35

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
SCHEMBL15478408 0.70 CCR1 (0.45) CCR1
SCHEMBL15478321 0.70 CCR1 (0.43) CCR1
SCHEMBL18895941 0.70 CCR1 (0.53) CCR1
SCHEMBL10287996 0.69 CCR1 (0.49) CCR1
SCHEMBL18895940 0.69 CCR1 (0.52) CCR1
SCHEMBL18633821 0.69 CCR1 (0.43) CCR1
SCHEMBL16312634 0.69 CCR1 (0.51) CCR1
SCHEMBL18633617 0.68 CCR1 (0.41) CCR1
SCHEMBL18895961 0.68 CCR1 (0.41) CCR1
SCHEMBL16312670 0.68 CCR1 (0.51) 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
Send feedback