SCHEMBL8870069

SCHEMBL8870069

COCCNC(=O)c1ccc(C(=O)NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)cn1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 4/20 0.57
MCL1 Q07820 10/20 0.55
BCL2L1 Q07817 9/20 0.55
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
EGFR P00533 1/20 0.45
SCN9A Q15858 1/20 0.44
SCN10A Q9Y5Y9 1/20 0.44

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
SCHEMBL8868915 0.92 P4HTM (0.66) P4HTMEGFR
SCHEMBL8868775 0.91 P4HTM (0.53) P4HTMMCL1BCL2L1NPC1RAB9A
SCHEMBL8869092 0.91 P4HTM (0.59) P4HTMMCL1BCL2L1EGFR
SCHEMBL8869962 0.88 P4HTM (0.58) P4HTMNPC1RAB9ASMN1; SMN2EGFR
SCHEMBL8870475 0.87 RAB9A (0.54) P4HTMMCL1BCL2L1NPC1RAB9A
SCHEMBL8869822 0.86 P4HTM (0.54) P4HTMNPC1RAB9ASMN1; SMN2
SCHEMBL8869178 0.86 P4HTM (0.54) P4HTMNPC1RAB9ASMN1; SMN2
SCHEMBL7869459 0.85 MCL1 (0.52) P4HTMMCL1BCL2L1CYP1A2CYP2C9
SCHEMBL8868425 0.85 P4HTM (0.53) P4HTMMCL1BCL2L1NPC1RAB9A
SCHEMBL9140706 0.85 P4HTM (0.64) P4HTMMCL1BCL2L1EGFR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed