SCHEMBL7874495

SCHEMBL7874495

CCOCCNC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(Cl)c(C(=O)NCCOc3ccccc3)c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
BCL2L1 Q07817 4/20 0.40
MCL1 Q07820 4/20 0.40
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
POLB P06746 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
SCHEMBL7867706 0.93 HPGD (0.48) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL7862781 0.92 POLB (0.43) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL7862784 0.92 HPGD (0.46) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL8869689 0.90 ALDH1A1 (0.49) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL7867840 0.89 POLB (0.42) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL7862722 0.89 NPC1 (0.51) HPGDNPC1RAB9ASMN1; SMN2BCL2L1
SCHEMBL9018349 0.88 ALDH1A1 (0.49) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL7870537 0.88 POLB (0.41) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL7874281 0.86 SMN1; SMN2 (0.43) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL9018281 0.85 ALDH1A1 (0.47) ALDH1A1HPGDNPC1RAB9ASMN1; SMN2

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