SCHEMBL6152905

SCHEMBL6152905

CC(C)(C)OC(=O)Nc1nc(-c2ccc(C(=O)N3CCN(S(=O)(=O)c4ccc5cc(Br)ccc5c4)CC3)cc2)c[nH]1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.55
LMNA P02545 2/20 0.44
ATM Q13315 1/20 0.44
MAPT P10636 2/20 0.43
THRB P10828 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL6152253 0.83 F10 (0.65) F10LMNAATMMAPTTHRB
SCHEMBL6152438 0.81 F10 (0.65) F10LMNAATMMAPTTHRB
SCHEMBL6196725 0.76 F10 (0.54) F10ATM
SCHEMBL6386353 0.75 F10 (0.66) F10LMNAATMMAPTTHRB
SCHEMBL6151827 0.75 F10 (0.63) F10ATMMAPTTHRBSMN1; SMN2
SCHEMBL6152664 0.74 F10 (0.65) F10LMNAATMMAPTTHRB
SCHEMBL6300113 0.74 F10 (0.65) F10ATMMAPTSMN1; SMN2
SCHEMBL5733762 0.74 F10 (0.72) F10LMNAATMSMN1; SMN2
SCHEMBL5734092 0.74 F10 (0.50) F10ATMSMN1; SMN2
SCHEMBL6306256 0.74 F10 (0.67) F10ATMSMN1; SMN2

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