SCHEMBL6152519

SCHEMBL6152519

NCc1ncccc1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc4cc(Cl)ccc4c3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.54
ATM Q13315 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
GAA P10253 1/20 0.49
LMNA P02545 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
F2 P00734 1/20 0.45

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
Hydrochloric Acid SCHEMBL6729226 0.85 F10 (0.59) F10ATMSMN1; SMN2
SCHEMBL6152729 0.84 F10 (0.47) F10ATMSMN1; SMN2GAALMNA
Hydrochloric Acid SCHEMBL6198569 0.82 ATM (0.55) F10ATMSMN1; SMN2GAALMNA
SCHEMBL6195355 0.82 ATM (0.61) F10ATMSMN1; SMN2GAALMNA
Hydrochloric Acid SCHEMBL6726014 0.82 ATM (0.52) F10ATMSMN1; SMN2GAALMNA
Hydrochloric Acid SCHEMBL6198123 0.81 ATM (0.60) F10ATMSMN1; SMN2GAALMNA
SCHEMBL5193868 0.80 ATM (0.71) F10ATMSMN1; SMN2GAALMNA
Hydrochloric Acid SCHEMBL5735796 0.80 F10 (0.60) F10ATMF2
SCHEMBL5734070 0.80 SMN1; SMN2 (0.66) F10ATMSMN1; SMN2LMNAL3MBTL1
Hydrochloric Acid SCHEMBL6729224 0.80 F10 (0.53) F10ATMGAALMNAL3MBTL1

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