SCHEMBL5326463

SCHEMBL5326463

CC(C)NC(=O)[C@@H]1CN(S(=O)(=O)c2ccc3c(Cl)c[nH]c3c2)CC(=O)N1C(c1ccc(=O)n(C)n1)C1CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.35
F2 P00734 1/20 0.35
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TP53 P04637 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.31

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
SCHEMBL4883307 0.91 GAA (0.32) F10F2ALDH1A1SMN1; SMN2LMNA
SCHEMBL4881821 0.91 ALDH1A1 (0.33) F10ALDH1A1SMN1; SMN2LMNAKMT2A
SCHEMBL4891921 0.91 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2LMNAKMT2A
SCHEMBL4893938 0.88 CASP3 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL5328237 0.78 MEN1 (0.31) KMT2A
SCHEMBL4883075 0.78 F10 (0.36) F10F2ALDH1A1SMN1; SMN2TP53
SCHEMBL4894919 0.78 F10 (0.36) F10F2ALDH1A1SMN1; SMN2TP53
SCHEMBL4894977 0.78 F10 (0.36) F10F2ALDH1A1SMN1; SMN2TP53
SCHEMBL5360429 0.77 F10 (0.38) F10F2
SCHEMBL4938813 0.77 F10 (0.38) 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
WO-2007008146-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 WO claimed