SCHEMBL5764784

SCHEMBL5764784

Cc1ccc(S(=O)(=O)O[C@@H]2C[C@@H](COO[Si](C)(C)C(C)(C)C)N(C(=O)OCc3ccccc3)C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.40
NPC1L1 Q9UHC9 1/20 0.37
LMNA P02545 1/20 0.37
ITGB1 P05556 4/20 0.36
ITGA5 P08648 4/20 0.36
ITGB3 P05106 3/20 0.36
ITGAV P06756 3/20 0.36
ITGA2B P08514 2/20 0.36
ITGB5 P18084 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
ABCB1 P08183 1/20 0.36
P2RX7 Q99572 2/20 0.36
MCL1 Q07820 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL6643379 0.92 ELANE (0.40) ELANENPC1L1LMNAITGB1ITGA5
SCHEMBL5765731 0.92 ELANE (0.40) ELANENPC1L1LMNAITGB1ITGA5
SCHEMBL9587450 0.87 ELANE (0.44) ELANENPC1L1LMNAITGB1ITGA5
SCHEMBL10512340 0.87 ELANE (0.44) ELANENPC1L1LMNAITGB1ITGA5
SCHEMBL12658835 0.85 ELANE (0.43) ELANENPC1L1LMNAITGB1ITGA5
SCHEMBL5941126 0.83 ELANE (0.44) ELANENPC1L1LMNAITGB1ITGA5
SCHEMBL5764192 0.83 ELANE (0.44) ELANENPC1L1LMNAITGB1ITGA5
SCHEMBL9384838 0.79 ABCB1 (0.40) ELANEITGB1ITGA5ITGB3ITGAV
SCHEMBL7347260 0.79 ELANE (0.45) ELANELMNACA1CA2MCL1
SCHEMBL9075147 0.79 ELANE (0.45) ELANELMNACA1CA2MCL1

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
EP-1377577-B1 PYRROLE DERIVATES FOR TREATING CYTOKINE MEDIATED DISEASES SANKYO CO (JP) 2006-06-14 EP disclosed