SCHEMBL6015020

SCHEMBL6015020

CN1C=C2C(=O)N(C3CCN(C(=O)[C@H](NC(=O)O)C(C)(C)C)C3)CN2C1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.36
VNN1 O95497 4/20 0.32
CTSK P43235 2/20 0.30

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
SCHEMBL6014965 0.94 CCR1 (0.39) CCR1CTSK
SCHEMBL3450384 0.92 CCR1 (0.31) CCR1VNN1
SCHEMBL3451234 0.89 CCR1 (0.36) CCR1
SCHEMBL3449103 0.86 CCR1 (0.34) CCR1
SCHEMBL3451244 0.86 CCR1 (0.34) CCR1
SCHEMBL3449185 0.85 CCR1 (0.34) CCR1
SCHEMBL3450336 0.84 CCR1 (0.41) CCR1
SCHEMBL3448971 0.82 CCR1 (0.34) CCR1CTSK
SCHEMBL6015022 0.82 CCR1 (0.37) CCR1
SCHEMBL6015098 0.82 ITGB3 (0.35) 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
EP-1695961-A1 UREA DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2006-08-30 EP disclosed