SCHEMBL7870461

SCHEMBL7870461

COCCNC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(CCNC(=O)CCc3ccccc3)cc2)cn1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.44
GAA P10253 1/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
P4HTM Q9NXG6 2/20 0.42
OPRM1 P35372 2/20 0.42
OPRD1 P41143 2/20 0.42
OPRK1 P41145 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL9574869 0.93 CA1 (0.47) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL7871678 0.93 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL7869478 0.93 KDM4E (0.44) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL7869429 0.91 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ALMNAPOLB
SCHEMBL9574752 0.91 L3MBTL1 (0.53) ALDH1A1MEN1KMT2ALMNAP4HTM
SCHEMBL7870523 0.91 MEN1 (0.47) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL7870440 0.90 PTPN1 (0.49) ALDH1A1LMNAKDM4EPOLBGAA
SCHEMBL7870511 0.90 ALDH1A1 (0.56) ALDH1A1MEN1KMT2ALMNAPOLB
SCHEMBL7874550 0.89 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ALMNAPOLB
SCHEMBL7870468 0.88 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ALMNAKDM4E

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