SCHEMBL13123761

SCHEMBL13123761

Cc1ncc2n1C(=O)N(N1CCN(C(=O)C(NC(=O)Nc3ccc(I)cc3)C(C)(C)C)CC1)C2

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.40
F2 P00734 2/20 0.34
NR3C1 P04150 3/20 0.31
FPR2 P25090 1/20 0.31
EPHX2 P34913 1/20 0.31
CNR1 P21554 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
SCHEMBL13123275 1.00 F10 (0.40) F10F2NR3C1FPR2EPHX2
SCHEMBL3449474 0.93 F10 (0.41) F10F2
SCHEMBL13123282 0.92 F10 (0.38) F10
SCHEMBL13123278 0.92 F10 (0.38) F10
SCHEMBL3450303 0.92 F10 (0.47) F10F2NR3C1FPR2
SCHEMBL3449908 0.92 F10 (0.47) F10F2NR3C1FPR2
SCHEMBL14541412 0.91 F10 (0.40) F10F2
SCHEMBL14541418 0.91 F10 (0.40) F10F2
SCHEMBL13123138 0.90 F10 (0.39) F10F2FPR2EPHX2
SCHEMBL13123309 0.90 F10 (0.41) F10F2FPR2EPHX2

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-7820673-B2 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed