SCHEMBL9490752

SCHEMBL9490752

CCS(=O)(=O)Nc1ccc(C(=O)O)cc1.[NaH]

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.70
LMNA P02545 2/20 0.70
HTT P42858 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NR3C2 P08235 1/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
PANK3 Q9H999 1/20 0.49
KMT2A Q03164 1/20 0.47
AR P10275 1/20 0.47
KIF11 P52732 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 1/20 0.47
IKBKB O14920 1/20 0.47
PTPRB P23467 1/20 0.47

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
SCHEMBL1017480 0.98 HPGD (0.72) HPGDLMNAHTTSMN1; SMN2NR3C2
SCHEMBL3555917 0.90 HPGD (0.62) HPGDLMNAHTTSMN1; SMN2NR3C2
SCHEMBL3559068 0.86 HPGD (0.59) HPGDLMNAHTTTSHRHSD17B10
SCHEMBL9489980 0.86 HPGD (0.57) HPGDLMNAHTTSMN1; SMN2CA12
SCHEMBL9514803 0.83 HPGD (0.69) HPGDLMNAHTTSMN1; SMN2NR3C2
SCHEMBL8231736 0.83 THRA (0.59) HPGDLMNASMN1; SMN2AR
SCHEMBL16051464 0.82 THRA (0.65) HPGDLMNASMN1; SMN2AR
SCHEMBL457811 0.81 HPGD (0.67) HPGDLMNAHTTSMN1; SMN2NR3C2
SCHEMBL7861945 0.81 HPGD (0.67) HPGDLMNAHTTSMN1; SMN2NR3C2
SCHEMBL10646367 0.81 HPGD (0.57) HPGDLMNAHTTSMN1; SMN2NR3C2

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-0324791-B1 ARYL-N-AMINOALKYL-4-(SULFONAMIDO)BENZAMIDES, ANTIARRHYTMIC AGENTS AND COMPOSITIONS THEREOF SCHERING AKTIENGESELLSCHAFT (DE) 1993-03-24 EP disclosed
US-4920116-A ANTIARRHYTHMIA AGENTS SCHERING A.G. (DE) 1990-04-24 US disclosed
EP-0324791-A1 ARYL-N-AMINOALKYL-4-(SULFONAMIDO)BENZAMIDES, ANTIARRHYTMIC AGENTS AND COMPOSITIONS THEREOF. SCHERING AG (DE) 1989-07-26 EP disclosed
WO-1988002362-A1 ARYL-N-AMINOALKYL-4-(SULFONAMIDO)BENZAMIDES, ANTIARRHYTMIC AGENTS AND COMPOSITIONS THEREOF SCHERING AKTIENGESELLSCHAFT (DE) 1988-04-07 WO disclosed