SCHEMBL8869989

SCHEMBL8869989

COc1ccc(CCNC(=O)c2ccc(S(=O)(=O)NC(=O)c3ccc(C(=O)NCC(=O)O)nc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.59
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
MAPT P10636 2/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
RAB9A P51151 2/20 0.48
PPARA Q07869 1/20 0.48
NPC1 O15118 1/20 0.46
EGLN1 Q9GZT9 1/20 0.46
KDM4E B2RXH2 1/20 0.45
OPRK1 P41145 2/20 0.45

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
SCHEMBL8868766 0.93 P4HTM (0.59) P4HTMKMT2AMEN1MAPTALDH1A1
SCHEMBL8868352 0.91 P4HTM (0.61) P4HTMKMT2AMEN1MAPTALDH1A1
SCHEMBL9138754 0.91 P4HTM (0.63) P4HTMKMT2AMEN1MAPTALDH1A1
SCHEMBL8868411 0.90 P4HTM (0.55) P4HTMKMT2AMEN1MAPTLMNA
SCHEMBL8869027 0.90 P4HTM (0.55) P4HTMKMT2AMEN1MAPTALDH1A1
SCHEMBL8867559 0.89 NLRP3 (0.54) P4HTMKMT2AMEN1MAPTALDH1A1
SCHEMBL8868488 0.89 LMNA (0.51) P4HTMKMT2AMEN1MAPTALDH1A1
SCHEMBL8869223 0.89 P4HTM (0.55) P4HTMKMT2AMEN1MAPTALDH1A1
SCHEMBL8869113 0.89 EGFR (0.54) P4HTMMAPTRAB9APPARANPC1
SCHEMBL9139877 0.89 P4HTM (0.63) P4HTMKMT2AMEN1MAPTALDH1A1

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