SCHEMBL6015007

SCHEMBL6015007

CCCCC(NC(=O)O)C(=O)N1CCC(N2Cc3cnc(C)n3C2=O)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.49
F2 P00734 3/20 0.49
CCKBR P32239 3/20 0.39
CCR1 P32246 2/20 0.35
CHEK1 O14757 1/20 0.33
P2RY12 Q9H244 7/20 0.33
PREP P48147 1/20 0.32
FAP Q12884 1/20 0.32

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
SCHEMBL6015001 1.00 F10 (0.49) F10F2CCKBRCCR1CHEK1
SCHEMBL6015069 0.94 F10 (0.51) F10F2CCKBRCCR1P2RY12
SCHEMBL6015075 0.94 F10 (0.51) F10F2CCKBRCCR1P2RY12
SCHEMBL6015111 0.91 F10 (0.52) F10F2CCR1
SCHEMBL6015113 0.91 F10 (0.52) F10F2CCR1
SCHEMBL3451656 0.89 F10 (0.45) F10F2
SCHEMBL6015147 0.88 F10 (0.49) F10F2
SCHEMBL6015032 0.87 F10 (0.51) F10F2CCKBRCCR1
SCHEMBL6015027 0.87 F10 (0.51) F10F2CCKBRCCR1
SCHEMBL3451653 0.86 F10 (0.52) F10F2CCKBRCCR1

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