Cyclopropane

Cyclopropane

SCHEMBL16986949

C1CC1.CN(C)c1ccccc1-c1ccc2nc(NC(=O)O)nn2c1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 14/20 0.53
▸ PIK3CD O00329 6/20 0.53
▸ TTK P33981 3/20 0.50
▸ PIK3CA P42336 7/20 0.47
▸ PIK3CB P42338 1/20 0.47
▸ LRRK2 Q5S007 2/20 0.43
▸ JAK2 O60674 1/20 0.42

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
Cyclopropane SCHEMBL16986946 0.78 JAK1 (0.50) JAK2
SCHEMBL3095594 0.74 PIK3CG (0.43) PIK3CGPIK3CDPIK3CAPIK3CBLRRK2
SCHEMBL3098937 0.70 PIK3CG (1.00) PIK3CGPIK3CDTTKPIK3CAPIK3CB
SCHEMBL3090226 0.69 PIK3CG (0.68) PIK3CGPIK3CDTTKPIK3CA
Cyclopropane SCHEMBL16175606 0.68 TTK (0.75) PIK3CGPIK3CDTTK
SCHEMBL3081503 0.67 PIK3CG (0.77) PIK3CGPIK3CDTTKPIK3CAPIK3CB
SCHEMBL3092025 0.66 PIK3CG (0.71) PIK3CGPIK3CDTTKPIK3CA
SCHEMBL3104880 0.66 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CB
Cyclopropane SCHEMBL16175566 0.65 TTK (0.73) PIK3CGTTKPIK3CALRRK2JAK2
SCHEMBL3098870 0.65 PIK3CG (0.74) PIK3CGPIK3CDTTKPIK3CAPIK3CB

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-2057158-B1 TRIAZOLE DERIVATIVES AS KINASE INHIBITORS CELLZOME LTD (GB) 2015-08-12 — — EP claimed
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