SCHEMBL13840282

SCHEMBL13840282

C/N=C1\CC2=C(CN(C3CCN(C(=O)CCS(=O)(=O)c4ccc5cc(Cl)ccc5c4)CC3)C2=O)N1C

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.59
F2 P00734 2/20 0.57

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
SCHEMBL14602212 0.83 F10 (0.53) F10F2
SCHEMBL15959322 0.78 F10 (0.73) F10F2
SCHEMBL13840366 0.77 F10 (0.59) F10F2
SCHEMBL2858958 0.76 F10 (0.77) F10F2
SCHEMBL948341 0.76 F10 (0.63) F10F2
Hydrochloric Acid SCHEMBL949834 0.75 F10 (0.62) F10F2
SCHEMBL2857500 0.75 F10 (1.00) F10F2
SCHEMBL15959333 0.75 F10 (0.74) F10F2
SCHEMBL947976 0.74 F10 (1.00) F10F2
SCHEMBL947727 0.74 F10 (0.75) F10F2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7534887-B2 Thiazoline derivative and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-19 US disclosed
US-7534887-B2 Thiazoline derivative and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-19 US disclosed