SCHEMBL8059524

SCHEMBL8059524

CS(=O)(=O)c1cc(C(=O)O)ccc1Oc1ccc(C(=S)Cc2ccccn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
MAPT P10636 2/20 0.50
MAPK14 Q16539 1/20 0.42
SYK P43405 4/20 0.41
AURKB Q96GD4 2/20 0.41
INCENP Q9NQS7 2/20 0.41
TTR P02766 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PARP10 Q53GL7 1/20 0.40
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CSNK2A2 P19784 1/20 0.38
CSNK2A1 P68400 1/20 0.38

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 SCHEMBL8070337 0.84 MAPT (0.38) KDM4EMAPTMAPK14MEN1KMT2A
SCHEMBL8059458 0.83 GPBAR1 (0.50)
SCHEMBL8070495 0.81 KDM4E (0.67) KDM4EMAPTLMNAGAATSHR
SCHEMBL8073882 0.81 GAA (0.39) KDM4EMAPTTTRGAAHTT
SCHEMBL8068695 0.80 ADRA1A (0.42) TTR
SCHEMBL7995261 0.80 TTR (0.61) TTRALDH1A1
SCHEMBL8073502 0.78 TTR (0.51) MAPTTTRPARP10GAAALDH1A1
SCHEMBL8446994 0.78 RAB9A (0.53) KDM4EMAPTTTRMEN1KMT2A
SCHEMBL8070326 0.78 ALDH1A1 (0.44) KDM4EMAPTMEN1KMT2ALMNA
SCHEMBL8815218 0.77 NR4A2 (0.58) MEN1KMT2APARP10SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6057322-A USEFUL IN TREATMENT OF CARDIOVASCULAR DISEASES HOECHST AKTIENGESELLSCHAFT (DE) 2000-05-02 US disclosed
EP-0723956-B1 Basically substituted benzoylguanidines, process for their preparation, their use as medicaments or diagnostics as well as medicaments containing them HOECHST AG (DE) 1999-10-13 EP disclosed