SCHEMBL9017995

SCHEMBL9017995

CCCOC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2cccc(C(=O)NCCCOC)c2)cn1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
GABRA5 P31644 1/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 3/20 0.39
BCL2L1 Q07817 1/20 0.39
MCL1 Q07820 1/20 0.39
LMNA P02545 1/20 0.39
ALOX12 P18054 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
P4HTM Q9NXG6 1/20 0.38
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL9018213 0.95 SMN1; SMN2 (0.45) KMT2AMAPTGAARAB9ASMN1; SMN2
SCHEMBL9018272 0.95 RAB9A (0.41) KMT2AGABRA5MAPTALDH1A1RAB9A
SCHEMBL9018238 0.93 KMT2A (0.43) KMT2AMAPTGAARAB9ASMN1; SMN2
SCHEMBL9018269 0.92 GABRA5 (0.44) KMT2AGABRA5MAPTALDH1A1RAB9A
SCHEMBL9018147 0.91 RAB9A (0.44) KMT2AMAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL9018099 0.90 SMN1; SMN2 (0.43) KMT2AGABRA5MAPTRAB9ASMN1; SMN2
SCHEMBL9018341 0.90 RAB9A (0.50) KMT2AMAPTRAB9ASMN1; SMN2BCL2L1
SCHEMBL9017996 0.90 RAB9A (0.40) KMT2AMAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL9018134 0.89 RAB9A (0.49) KMT2AMAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL9018092 0.89 SMN1; SMN2 (0.47) KMT2AMAPTALDH1A1GAARAB9A

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
EP-0590520-B1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AG (DE) 1996-06-12 EP disclosed
EP-0590520-A1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1994-04-06 EP disclosed