SCHEMBL8743804

SCHEMBL8743804

CS(=O)(=O)c1cc(C(=O)NC(=N)N)ccc1Oc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
SCN9A Q15858 2/20 0.41
TBXA2R P21731 3/20 0.40
PNLIP P16233 1/20 0.39
F2 P00734 1/20 0.39
F10 P00742 1/20 0.39
MAPK14 Q16539 1/20 0.39
PTGDR Q13258 2/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
BRAF P15056 1/20 0.38
HDAC1 Q13547 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 SCHEMBL8743787 0.99 KMT2A (0.41) KMT2AMEN1SCN9ATBXA2RPNLIP
SCHEMBL8068683 0.93 SMN1; SMN2 (0.41) F10HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL8059609 0.92 SMN1; SMN2 (0.40) F10HTTSMN1; SMN2
SCHEMBL8743801 0.90 PARP10 (0.40) F10HTTSMN1; SMN2
SCHEMBL8379266 0.90 HPGD (0.41) KMT2AF10ALDH1A1HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL8816980 0.89 P2RX4 (0.43) KMT2AMEN1PNLIPF2F10
SCHEMBL8743793 0.89 MRGPRX1 (0.44) TBXA2RF2F10SMN1; SMN2BRAF
Hydrochloric Acid SCHEMBL8743791 0.89 PARP10 (0.40) F10
Hydrochloric Acid SCHEMBL8374986 0.89 HPGD (0.40) KMT2AMEN1F10ALDH1A1HTT
SCHEMBL8499411 0.88 GCK (0.42) F10

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0589336-B1 Benzoylguanidines, process for their preparation and their use as antiarrhythmic agents HOECHST AG (DE) 1997-01-08 EP claimed