SCHEMBL6152664

SCHEMBL6152664

O=C(c1ccc(-c2ccc(=O)[nH]n2)cc1)N1CCN(S(=O)(=O)c2ccc3cc(Br)ccc3c2)CC1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.65
ALDH1A1 P00352 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
MAPT P10636 2/20 0.58
THRB P10828 1/20 0.52
ATM Q13315 1/20 0.52
LMNA P02545 2/20 0.51

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
SCHEMBL6152346 0.89 ALDH1A1 (0.59) F10ALDH1A1L3MBTL1MAPTATM
SCHEMBL5326524 0.85 L3MBTL1 (0.54) F10ALDH1A1L3MBTL1MAPTTHRB
SCHEMBL5322343 0.84 ALDH1A1 (0.53) F10ALDH1A1L3MBTL1MAPTTHRB
SCHEMBL5327745 0.84 MAPT (0.52) F10ALDH1A1L3MBTL1MAPTTHRB
SCHEMBL6151827 0.82 F10 (0.63) F10MAPTTHRBATM
SCHEMBL6152253 0.81 F10 (0.65) F10ALDH1A1MAPTTHRBATM
SCHEMBL6152438 0.81 F10 (0.65) F10MAPTTHRBATMLMNA
SCHEMBL5733762 0.81 F10 (0.72) F10L3MBTL1ATMLMNA
SCHEMBL6306256 0.81 F10 (0.67) F10ATM
SCHEMBL6306689 0.80 F10 (0.63) F10MAPTTHRBATMLMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082303-B1 HETEROCYCLIC DERIVATIVES WHICH INHIBIT FACTOR XA ASTRAZENECA AB (SE) 2005-01-26 EP disclosed
US-6395731-B1 ANTICOAGULANTS ASTRAZENECA AB (SE) 2002-05-28 US disclosed
EP-1082303-A1 HETEROCYCLIC DERIVATIVES WHICH INHIBIT FACTOR XA AstraZeneca AB (SE) 2001-03-14 EP disclosed
WO-1999057099-A1 HETEROCYCLIC DERIVATIVES WHICH INHIBIT FACTOR XA ASTRAZENECA AB (SE) 1999-11-11 WO disclosed