SCHEMBL13151478

SCHEMBL13151478

Cn1c(C(=O)N[C@@H]2CCC3CN(C(=O)OC(C)(C)C)CC[C@H]3C2)cc2cc(Cl)ccc21

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 7/20 0.56
▸ RXFP1 Q9HBX9 1/20 0.45
▸ AHR P35869 1/20 0.44
▸ ANO1 Q5XXA6 2/20 0.41
▸ F10 P00742 2/20 0.40
▸ MAPK8 P45983 1/20 0.40
▸ CNR1 P21554 2/20 0.40
▸ CNR2 P34972 2/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38

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
SCHEMBL10112550 1.00 USP30 (0.56) USP30RXFP1AHRANO1F10
SCHEMBL13151484 0.85 RXFP1 (0.52) USP30RXFP1AHRMEN1KMT2A
SCHEMBL47199 0.85 RXFP1 (0.52) USP30RXFP1AHRMEN1KMT2A
SCHEMBL29779214 0.72 USP30 (1.00) USP30
SCHEMBL18124076 0.72 USP30 (1.00) USP30
SCHEMBL23585226 0.72 USP30 (1.00) USP30
SCHEMBL19332054 0.72 USP30 (0.55) USP30RXFP1MAPK8CNR1CNR2
SCHEMBL15077715 0.71 JAK2 (0.47) JAK2JAK1
SCHEMBL16192279 0.71 JAK2 (0.47) JAK2JAK1
SCHEMBL19992743 0.68 GPR119 (0.50) USP30

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
WO-2010119984-A1 3-ARYL OR HETEROARYL-SUBSTITUTED INDOLE DERIVATIVE BANYU PHARMACEUTICAL CO.,LTD. (JP) 2010-10-21 — — WO disclosed
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