SCHEMBL8547438

SCHEMBL8547438

CC(C)CC(CN1CCC[C@H]1C(=O)NCCCCc1ccccc1)NS(C)(=O)=O

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 17/20 0.54
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 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
SCHEMBL8544850 1.00 FKBP1A (0.54) FKBP1AMMP1MMP3
SCHEMBL8547442 1.00 FKBP1A (0.54) FKBP1AMMP1MMP3
SCHEMBL8543982 0.91 FKBP1A (0.51) FKBP1AMMP1MMP3
SCHEMBL8543984 0.91 FKBP1A (0.51) FKBP1AMMP1MMP3
SCHEMBL8541292 0.91 FKBP1A (0.51) FKBP1AMMP1MMP3
SCHEMBL8543354 0.88 FKBP1A (0.60) FKBP1A
SCHEMBL8543352 0.88 FKBP1A (0.60) FKBP1A
SCHEMBL8548543 0.87 FKBP1A (0.59) FKBP1A
SCHEMBL8543842 0.87 FKBP1A (0.59) FKBP1A
SCHEMBL8548538 0.87 FKBP1A (0.59) FKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0610744-B1 Sulfonamide aminomethylene derivatives as immunosuppressants BAYER AG (US) 1998-11-04 EP claimed
US-5633277-A ANTIINFLAMMATORY MILES INC. (US) 1997-05-27 US claimed
EP-0610744-A1 Sulfonamide aminomethylene derivatives as immunosuppressants Bayer Corporation (US) 1994-08-17 EP claimed
EP-0610744-B1 Sulfonamide aminomethylene derivatives as immunosuppressants BAYER AG (US) 1998-11-04 EP disclosed
US-5633277-A ANTIINFLAMMATORY MILES INC. (US) 1997-05-27 US disclosed
EP-0610744-A1 Sulfonamide aminomethylene derivatives as immunosuppressants Bayer Corporation (US) 1994-08-17 EP disclosed