SCHEMBL1384352

SCHEMBL1384352

O=C(Cn1c(C(=O)Nc2ccc(N3CCOC3=O)cc2)nc2ccccc21)Nc1ccc(Cl)cn1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.68
KDR P35968 2/20 0.45
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
KMT2A Q03164 1/20 0.42
F2 P00734 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL1378964 0.89 F10 (0.66) F10KDR
SCHEMBL3371388 0.87 F10 (0.51) F10KDRALDH1A1KDM4EMEN1
SCHEMBL1381365 0.84 F10 (0.66) F10KDRALDH1A1KDM4EMEN1
SCHEMBL1381239 0.84 F10 (0.67) F10KDRALDH1A1KDM4EMEN1
SCHEMBL1382719 0.83 F10 (0.75) F10KDRALDH1A1KDM4EMEN1
SCHEMBL1382657 0.81 F10 (1.00) F10KDRALDH1A1KDM4EMEN1
SCHEMBL1381284 0.80 F10 (0.76) F10KDRALDH1A1KDM4EMEN1
SCHEMBL3371107 0.77 F10 (0.52) F10KDR
SCHEMBL4710687 0.77 F10 (0.47) F10LMNAKMT2ASMN1; SMN2
SCHEMBL3372955 0.76 F10 (0.50) F10ALDH1A1KDM4EMEN1LMNA

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
JP-4658940-B2 2011-03-23 JP claimed