SCHEMBL5736610

SCHEMBL5736610

Nc1ncc(-c2ccc(C(=O)N3CCN(S(=O)(=O)c4ccc5cc(Cl)ccc5c4)CC3)cc2)cn1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.56
ATM Q13315 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.51
F2 P00734 2/20 0.49

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 SCHEMBL6195200 0.99 F10 (0.55) F10ATMSMN1; SMN2F2
Hydrochloric Acid SCHEMBL5737086 0.91 F10 (0.55) F10ATMSMN1; SMN2F2
SCHEMBL5734654 0.88 ATM (0.59) F10ATMSMN1; SMN2F2
Hydrochloric Acid SCHEMBL6197875 0.88 F10 (0.60) F10ATM
SCHEMBL6728205 0.87 ATM (0.55) F10ATMSMN1; SMN2F2
SCHEMBL5193868 0.86 ATM (0.71) F10ATMSMN1; SMN2F2
Hydrochloric Acid SCHEMBL6197839 0.86 ATM (0.54) F10ATMSMN1; SMN2F2
SCHEMBL5736203 0.86 ATM (0.54) F10ATMSMN1; SMN2F2
SCHEMBL5736178 0.85 F10 (0.64) F10ATM
Hydrochloric Acid SCHEMBL6195419 0.85 ATM (0.69) F10ATMSMN1; SMN2F2

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-0986551-B1 SULFONAMIDE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA PHARMACEUTICAL (JP) 2006-08-02 EP disclosed
US-6359134-B1 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-03-19 US disclosed
EP-0986551-A1 SULFONAMIDE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Pharmaceutical Company Limited (JP) 2000-03-22 EP disclosed
WO-1998054164-A1 SULFONAMIDE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-03 WO disclosed