SCHEMBL11190192

SCHEMBL11190192

CC(SC(=O)c1cccs1)C(=O)NC(CSCC(=O)O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.51
▸ ACE P12821 5/20 0.41
▸ RAB9A P51151 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ MMP1 P03956 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ADAM17 P78536 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ATM Q13315 1/20 0.38

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
SCHEMBL11187178 1.00 ELANE (0.51) ELANEACERAB9AHPGDMMP1
SCHEMBL11189604 0.86 ELANE (0.51) ELANEACERAB9AHPGDMMP1
SCHEMBL11189623 0.86 ELANE (0.51) ELANEACERAB9AHPGDMMP1
SCHEMBL11188353 0.86 ELANE (0.55) ELANEACERAB9AHPGDMAPT
SCHEMBL11188356 0.86 ELANE (0.55) ELANEACERAB9AHPGDMAPT
SCHEMBL11189007 0.80 ELANE (0.59) ELANERAB9AHPGDMAPTKMT2A
SCHEMBL11189010 0.80 ELANE (0.59) ELANERAB9AHPGDMAPTKMT2A
Stepronin SCHEMBL19339 0.77 ELANE (0.56) ELANEACERAB9AHPGDMAPT
Stepronin SCHEMBL19338 0.77 ELANE (0.56) ELANEACERAB9AHPGDMAPT
SCHEMBL7314482 0.76 ELANE (0.56) ELANERAB9AHPGDMAPTADAM17

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-4405638-A ANTITUSSIVE AGENTS; ANTIINFLAMMATORY AGENTS; RESPIRATORY SYSTEM DISORDERS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A (IT) 1983-09-20 — — US claimed
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