SCHEMBL9040944

SCHEMBL9040944

CS(=O)(=O)c1cc(C(=O)O)cc(Cl)c1OCC(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.43
TPMT P51580 1/20 0.41
ACLY P53396 4/20 0.40
POLB P06746 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MRGPRX4 Q96LA9 4/20 0.37
PDK1 Q15118 1/20 0.37
PDK2 Q15119 1/20 0.37
PDK3 Q15120 1/20 0.37
PDK4 Q16654 1/20 0.37
CNR2 P34972 1/20 0.37
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TTR P02766 1/20 0.36
RXRA P19793 1/20 0.36
HNF4A P41235 1/20 0.36

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 SCHEMBL9436652 0.82 SLC9A1 (0.43)
Hydrochloric Acid SCHEMBL9436646 0.81 ALDH1A1 (0.37) ACLYHTTCNR2KMT2A
SCHEMBL16759783 0.75 L3MBTL1 (0.49) L3MBTL1MRGPRX4CNR2RXRAHNF4A
SCHEMBL9043010 0.73 KDM4E (0.47) PLAUTPMTACLYTTR
SCHEMBL11844723 0.72 L3MBTL1 (0.40) PLAUALOX15HTTL3MBTL1KMT2A
SCHEMBL9038640 0.72 TTR (0.48) TPMTACLYPOLBKMT2ASMN1; SMN2
SCHEMBL8492178 0.71 LMNA (0.41) ACLYALOX15HTTL3MBTL1MRGPRX4
SCHEMBL9042697 0.70 TTR (0.47) PLAUTPMTACLYPOLBKMT2A
SCHEMBL31401376 0.70 TTR (0.47) TPMTACLYPOLBL3MBTL1KMT2A
SCHEMBL8161835 0.70 L3MBTL1 (0.49) TPMTPOLBALOX15HTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0556674-B1 3,5-substituted benzoylguanidines with antiarrhythmic activity and cell proliferation inhibiting activity HOECHST AG (DE) 1996-06-19 EP disclosed
US-5373024-A 3,5-Substituted benzoylguanidines, process for their preparation, their use as a medicament of diagnostic and medicament containing them HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-13 US disclosed
EP-0556674-A1 3,5-substituted benzoylguanidines with antiarrhythmic activity and cell proliferation inhibiting activity HOECHST AKTIENGESELLSCHAFT (DE) 1993-08-25 EP disclosed