SCHEMBL6620330

SCHEMBL6620330

C=CCC1=C2[C@@H](CCN2C(=O)OCc2ccccc2)N(S(=O)(=O)c2cc3ccccc3s2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.43
F2 P00734 3/20 0.40
CTSG P08311 2/20 0.40
F10 P00742 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
F13A1 P00488 5/20 0.35
TGM2 P21980 5/20 0.35
TGM1 P22735 5/20 0.35
AADAT Q8N5Z0 1/20 0.35
TGM3 Q08188 1/20 0.34
MMP13 P45452 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL6618188 0.85 ELANE (0.58) ELANEF2CTSGF10F13A1
SCHEMBL6621227 0.84 ELANE (0.43) ELANEF2CTSGNPC1RAB9A
SCHEMBL6618855 0.83 ELANE (0.52) ELANEF2CTSGNPC1RAB9A
SCHEMBL6624122 0.83 ELANE (0.52) ELANEF2CTSGNPC1RAB9A
SCHEMBL6621004 0.82 ELANE (0.45) ELANEF2CTSGNPC1RAB9A
SCHEMBL6616802 0.81 ELANE (0.42) ELANEF2CTSGNPC1RAB9A
SCHEMBL6622716 0.80 ELANE (0.47) ELANESMN1; SMN2
SCHEMBL6620056 0.80 ELANE (0.46) ELANEF2CTSGNPC1RAB9A
SCHEMBL6620157 0.80 ELANE (0.43) ELANEF2CTSGNPC1RAB9A
SCHEMBL6622226 0.80 ELANE (0.42) ELANEF2CTSGNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891362-B1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LTD (GB) 2004-03-17 EP disclosed
US-6215002-B1 CYCLIZATION, DEBLOCKING, DEPROTECTION, SULFONATION, CONDENSATION, AMIDATION; ANTIINFLAMMATORY AGENTS; RESPIRATORY SYSTEM DISORDERS GLAXO WELLCOME INC. 2001-04-10 US disclosed
US-6057457-A ENZYME INHIBITORS FOR PROTEASE OR ENZYMES OF HYDROLYSIS GLAXO WELLCOME INC. (US) 2000-05-02 US disclosed
US-5994344-A BRONCHITIS THERAPY GLAXO WELLCOME INC. (US) 1999-11-30 US disclosed