SCHEMBL6152438

SCHEMBL6152438

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

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.65
ATM Q13315 1/20 0.52
MAPT P10636 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.46
THRB P10828 1/20 0.46
LMNA P02545 2/20 0.46

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 0.89 F10 (0.65) F10ATMMAPTTHRBLMNA
Hydrochloric Acid SCHEMBL6194130 0.88 F10 (0.55) F10ATM
SCHEMBL6152664 0.81 F10 (0.65) F10ATMMAPTTHRBLMNA
SCHEMBL5733762 0.81 F10 (0.72) F10ATMSMN1; SMN2LMNA
SCHEMBL6306256 0.81 F10 (0.67) F10ATMSMN1; SMN2
SCHEMBL6152905 0.81 F10 (0.55) F10ATMMAPTSMN1; SMN2THRB
SCHEMBL6386353 0.80 F10 (0.66) F10ATMMAPTSMN1; SMN2THRB
SCHEMBL6306689 0.80 F10 (0.63) F10ATMMAPTSMN1; SMN2THRB
SCHEMBL6151827 0.80 F10 (0.63) F10ATMMAPTSMN1; SMN2THRB
SCHEMBL6299380 0.80 F10 (0.66) F10ATMMAPTSMN1; SMN2LMNA

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