SCHEMBL7075110

SCHEMBL7075110

Cc1cc(C)c(S(=O)(=O)N2CCN(OC(=O)Nc3ccc(-c4noc(C)n4)cc3)CC2)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.49
POLB P06746 2/20 0.48
MAPT P10636 6/20 0.46
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
THRB P10828 1/20 0.45
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPK1 P28482 1/20 0.41
MAPK14 Q16539 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
SCHEMBL7652755 0.86 MAPT (0.59) LMNAPOLBMAPTTHRBMEN1
SCHEMBL7071592 0.84 LMNA (0.50) LMNAPOLBMAPTHPGDHTT
SCHEMBL7074156 0.84 LMNA (0.55) LMNAPOLBMAPTHPGDHTT
SCHEMBL7070051 0.82 LMNA (0.52) LMNAPOLBMAPTHPGDHTT
SCHEMBL7076643 0.81 LMNA (0.53) LMNAPOLBMAPTHPGDHTT
SCHEMBL7076839 0.80 KMT2A (0.59) LMNAPOLBMAPTTHRBMEN1
SCHEMBL7074841 0.79 KMT2A (0.45) LMNAPOLBMAPTMEN1KMT2A
SCHEMBL7070001 0.78 THRB (0.63) LMNAPOLBMAPTHTTTHRB
SCHEMBL7072193 0.78 GAA (0.45) LMNAPOLBMAPTHPGDHTT
SCHEMBL7075151 0.77 HDAC4 (0.49) LMNAMAPTTHRBMEN1KMT2A

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-1025086-B1 BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GMBH (DE) 2003-06-25 EP disclosed