SCHEMBL6015124

SCHEMBL6015124

Cc1nc(C)n2c1CN(CCN1CCN(C(=O)[C@H](NC(=O)O)C(C)(C)C)CC1)C2=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
CNR2 P34972 2/20 0.31
F10 P00742 1/20 0.31
CCR1 P32246 1/20 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
SCHEMBL3449738 0.86 F10 (0.35) CNR2F10CCR1
SCHEMBL3449282 0.84 CNR1 (0.38) POLBF10CCR1
SCHEMBL3449631 0.82 POLB (0.33) POLBRXFP1
SCHEMBL3449353 0.81 CCR1 (0.32) CNR2F10CCR1
SCHEMBL3452128 0.79 F10 (0.45) CNR2F10CCR1
SCHEMBL3448667 0.73 CCR1 (0.41) F10CCR1
SCHEMBL3449592 0.70 MC4R (0.44) POLB
SCHEMBL3450071 0.69 F10 (0.41) F10CCR1
SCHEMBL3447791 0.69 F10 (0.33) F10
SCHEMBL6015076 0.69 F10 (0.42) CNR2F10CCR1

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