SCHEMBL8869725

SCHEMBL8869725

CC(C)OC(=O)CNC(=O)c1ccc(C(=O)NS(=O)(=O)CCOc2ccc(F)cc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 9/20 0.39
CXCR1 P25024 3/20 0.39
CXCR2 P25025 3/20 0.39
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 1/20 0.39
POLB P06746 2/20 0.39
PRKAA2 P54646 1/20 0.38
EGLN1 Q9GZT9 2/20 0.37
KMT2A Q03164 1/20 0.36

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
SCHEMBL8868040 0.91 P4HTM (0.47) P4HTMALDH1A1RAB9APOLBEGLN1
SCHEMBL9137956 0.89 P4HTM (0.43) P4HTMCXCR1CXCR2ALDH1A1RAB9A
SCHEMBL8869722 0.88 CXCR1 (0.44) P4HTMCXCR1CXCR2ALDH1A1RAB9A
SCHEMBL8867737 0.88 P4HTM (0.40) P4HTMCXCR1CXCR2POLBPRKAA2
SCHEMBL8869383 0.87 P4HTM (0.46) P4HTMALDH1A1RAB9APRKAA2EGLN1
SCHEMBL8869212 0.84 RAB9A (0.48) P4HTMALDH1A1RAB9APOLBPRKAA2
SCHEMBL8870011 0.84 PRKAA2 (0.45) P4HTMALDH1A1RAB9APOLBPRKAA2
SCHEMBL8868451 0.83 CXCR1 (0.46) P4HTMCXCR1CXCR2ALDH1A1RAB9A
SCHEMBL8867749 0.83 P4HTM (0.48) P4HTMCXCR1CXCR2ALDH1A1PRKAA2
SCHEMBL9018316 0.82 CXCR1 (0.45) CXCR1CXCR2ALDH1A1RAB9APOLB

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