SCHEMBL7862722

SCHEMBL7862722

CCOCCNC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(C(=O)NCCOc3ccccc3)cc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.51
RAB9A P51151 8/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
HPGD P15428 1/20 0.46
POLB P06746 1/20 0.45
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
BCL2L1 Q07817 4/20 0.44
MCL1 Q07820 4/20 0.44
P4HTM Q9NXG6 2/20 0.43
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41

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
SCHEMBL7867703 0.93 EGFR (0.45) NPC1RAB9ASMN1; SMN2HPGDP4HTM
SCHEMBL7871544 0.91 MCL1 (0.49) BCL2L1MCL1P4HTM
SCHEMBL7874619 0.91 HPGD (0.47) NPC1RAB9ASMN1; SMN2HPGDP4HTM
SCHEMBL7867895 0.90 NPC1 (0.51) NPC1RAB9ASMN1; SMN2HPGDPOLB
SCHEMBL9574842 0.90 EGFR (0.43) NPC1RAB9ASMN1; SMN2HPGDP4HTM
SCHEMBL7869460 0.90 EGFR (0.43) NPC1RAB9ASMN1; SMN2HPGDP4HTM
SCHEMBL7871550 0.90 NPC1 (0.43) NPC1RAB9ASMN1; SMN2HPGDPOLB
SCHEMBL7874534 0.89 EGFR (0.42) NPC1RAB9ASMN1; SMN2HPGDP4HTM
SCHEMBL7862692 0.89 EGFR (0.43) NPC1RAB9ASMN1; SMN2HPGDP4HTM
SCHEMBL9574776 0.89 ALDH1A1 (0.44) NPC1RAB9ASMN1; SMN2HPGDP4HTM

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-0562512-B1 Sulfonamidocarbonylpyridine-2-carboxamides and their use as medicines HOECHST AG (DE) 2001-02-21 EP disclosed
EP-0562512-A1 Sulfonamido- and sulfonamidocarbonyl-pyridine-2-carboxamides and their pyridine-N-oxides, process for their preparation and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1993-09-29 EP disclosed