SCHEMBL5734273

SCHEMBL5734273

Cc1nc(-c2ccc(N)nc2)sc1C(=O)N1CCN(S(=O)(=O)c2ccc3cc(Cl)ccc3c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.50
F2 P00734 3/20 0.50
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.42
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL5737352 0.86 SMN1; SMN2 (0.54) F10F2ALDH1A1LMNASMN1; SMN2
SCHEMBL5734359 0.86 F10 (0.54) F10F2LMNAGAASMN1; SMN2
SCHEMBL5734011 0.84 F10 (0.44) F10F2ALDH1A1THRATHRB
SCHEMBL5735028 0.83 LMNA (0.53) F10F2ALDH1A1LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL5737086 0.81 F10 (0.55) F10F2SMN1; SMN2
SCHEMBL5734679 0.79 F10 (0.44) F10F2ALDH1A1LMNAGAA
SCHEMBL5735064 0.78 LSS (0.54) ALDH1A1LMNATHRATHRBGAA
SCHEMBL5735531 0.77 MAPT (0.53) ALDH1A1LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL5733711 0.77 F10 (0.51) F10F2ALDH1A1
SCHEMBL5734474 0.77 ATM (0.66) ALDH1A1LMNAGAASMN1; 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-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