Sugi Predict

Sugi Predict / Compounds / Cyclopropane

Cyclopropane

Cyclopropane

SCHEMBL4200950

C1CC1.CCOc1cc(C(CC(N)=O)N2Cc3cccc(NC(=O)O)c3C2=O)ccc1OC(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 12/20 0.51
▸ PDE4C Q08493 12/20 0.51
▸ PDE4A P27815 8/20 0.51
▸ PDE4D Q08499 8/20 0.51
▸ TNF P01375 2/20 0.46
▸ TP53 P04637 1/20 0.43
▸ HTR2B P41595 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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 SCHEMBL4206835 0.94 PDE4A (0.41) PDE4BPDE4CPDE4APDE4DTNF
SCHEMBL1143494 0.92 PDE4B (0.60) PDE4BPDE4CPDE4APDE4DTNF
Cyclopropane SCHEMBL4206831 0.92 TP53 (0.46) PDE4BPDE4CPDE4APDE4DTP53
SCHEMBL1143520 0.89 PDE4B (0.49) PDE4BPDE4CPDE4APDE4DTNF
Cyclopropane SCHEMBL4206531 0.89 PDE4B (0.51) PDE4BPDE4CPDE4APDE4DHTR2B
Cyclopropane SCHEMBL4204875 0.87 MEN1 (0.39) PDE4BPDE4CPDE4APDE4DTP53
SCHEMBL1143574 0.87 PDE4A (0.51) PDE4BPDE4CPDE4APDE4DTNF
Cyclopropane SCHEMBL4216961 0.86 PDE4B (0.44) PDE4BPDE4CPDE4APDE4DTNF
SCHEMBL2979248 0.86 TNF (0.51) PDE4BPDE4CPDE4APDE4DTNF
Cyclopropane SCHEMBL4211055 0.85 MEN1 (0.41) TP53MEN1KMT2A

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-1587474-B1 FLUOROALKOXY-SUBSTITUTED 1, 3-DIHYDRO-ISOINDOLYL COMPOUNDS AND THEIR PHARMACEUTICAL USES CELGENE CORP (US) 2009-11-18 — — EP claimed