SCHEMBL6152346

SCHEMBL6152346

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

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
F10 P00742 16/20 0.56
ATM Q13315 1/20 0.52
F2 P00734 2/20 0.49
MAPT P10636 1/20 0.48

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
SCHEMBL6152664 0.89 F10 (0.65) ALDH1A1L3MBTL1F10ATMMAPT
SCHEMBL5735457 0.87 F10 (0.58) F10ATMF2
SCHEMBL5326524 0.85 L3MBTL1 (0.54) ALDH1A1L3MBTL1F10ATMMAPT
SCHEMBL4900354 0.85 F10 (0.65) F10
SCHEMBL5322343 0.84 ALDH1A1 (0.53) ALDH1A1L3MBTL1F10ATMMAPT
SCHEMBL5326485 0.84 ALDH1A1 (0.48) ALDH1A1L3MBTL1F10ATMMAPT
SCHEMBL5323222 0.83 L3MBTL1 (0.47) ALDH1A1L3MBTL1F10ATMMAPT
SCHEMBL5733653 0.82 F10 (0.57) F10ATMF2
SCHEMBL5737277 0.81 F10 (0.56) F10ATMF2
SCHEMBL5193868 0.81 ATM (0.71) L3MBTL1F10ATMF2

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