SCHEMBL740470

SCHEMBL740470

CC(C)N1CCc2nc(C(=O)NC3CC(CO)CC3(N)C(=O)c3cc4cc(Cl)ccc4[nH]3)sc2C1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.57
F2 P00734 4/20 0.52

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
Hydrochloric Acid SCHEMBL740568 0.99 F10 (0.56) F10F2
SCHEMBL741905 0.91 F10 (0.69) F10F2
Hydrochloric Acid SCHEMBL743646 0.91 F10 (0.68) F10F2
Hydrochloric Acid SCHEMBL743690 0.86 F10 (0.57) F10F2
Hydrochloric Acid SCHEMBL740887 0.85 F10 (0.58) F10F2
SCHEMBL763978 0.85 F10 (0.75) F10F2
SCHEMBL10476701 0.85 F10 (0.75) F10F2
SCHEMBL10476702 0.85 F10 (0.75) F10F2
SCHEMBL742505 0.85 F10 (0.71) F10F2
Hydrochloric Acid SCHEMBL4098391 0.84 F10 (0.74) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2431370-A1 Monoacylated 1,2-diaminocycloalkanes DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2012-03-21 EP disclosed