Cyclopropane

Cyclopropane

SCHEMBL16986945

C1CC1.O=C(O)Nc1nc2cccc(-c3ccoc3)n2n1

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 1/20 0.73
JAK1 P23458 12/20 0.53
JAK2 O60674 10/20 0.51
TYK2 P29597 2/20 0.47
EGLN2 Q96KS0 1/20 0.46
JAK3 P52333 1/20 0.45

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 SCHEMBL16986950 0.85 JAK1 (0.70) MAP3K5JAK1JAK2TYK2EGLN2
SCHEMBL2772932 0.85 MAP3K5 (1.00) MAP3K5JAK1JAK2
SCHEMBL2789563 0.84 JAK1 (0.69) MAP3K5JAK1JAK2TYK2JAK3
SCHEMBL2787903 0.84 JAK1 (0.73) MAP3K5JAK1JAK2TYK2JAK3
SCHEMBL2788079 0.83 MAP3K5 (0.85) MAP3K5JAK1JAK2EGLN2
SCHEMBL2787002 0.82 MAP3K5 (0.89) MAP3K5JAK1JAK2TYK2
SCHEMBL2787966 0.82 MAP3K5 (0.71) MAP3K5JAK1JAK2JAK3
SCHEMBL2788369 0.81 MAP3K5 (0.83) MAP3K5JAK1JAK2TYK2EGLN2
SCHEMBL12317235 0.81 MAP3K5 (0.72) MAP3K5JAK1JAK2EGLN2
SCHEMBL2785356 0.80 MAP3K5 (0.65) MAP3K5JAK1JAK2TYK2EGLN2

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