SCHEMBL13725901

SCHEMBL13725901

CNC(=O)c1ccc(NC(=O)[C@H]2C[C@@H](O)CN2C(=O)Nc2ccc(Cl)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.58
POLB P06746 2/20 0.57
KLKB1 P03952 4/20 0.47
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.43
CCR1 P32246 1/20 0.40

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
SCHEMBL3590288 0.89 F10 (0.62) F10POLBKLKB1MEN1KMT2A
SCHEMBL8280052 0.87 POLB (0.58) F10POLBKLKB1MEN1KMT2A
SCHEMBL3835351 0.87 F10 (0.58) F10POLBKLKB1MEN1KMT2A
SCHEMBL3834358 0.86 F10 (0.62) F10POLBKLKB1MEN1KMT2A
SCHEMBL3830778 0.85 F10 (0.59) F10POLBKLKB1MEN1KMT2A
SCHEMBL8272842 0.85 F10 (0.59) F10POLBKLKB1MEN1KMT2A
SCHEMBL8282294 0.84 F10 (0.55) F10POLBKLKB1MEN1KMT2A
SCHEMBL3588150 0.84 F10 (0.62) F10POLBKLKB1MEN1KMT2A
SCHEMBL3832105 0.83 F10 (0.59) F10POLBKLKB1MAPT
SCHEMBL8273027 0.83 F10 (0.59) F10POLBKLKB1KMT2AMAPT

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
EP-2085391-A2 Inhibitors of factor XA and other serine proteases involved in the coagulation cascade Warner-Lambert Company LLC (US) 2009-08-05 EP disclosed
EP-1671949-B1 Substituted Pyridinylamines WARNER LAMBERT CO (US) 2008-07-23 EP disclosed