SCHEMBL8545290

SCHEMBL8545290

Cc1cc(OCCN(C)c2ccncc2)cc(OS(=O)(=O)c2ccccc2Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 20/20 1.00
CTRC Q99895 6/20 1.00
PRSS2 P07478 6/20 1.00
F10 P00742 4/20 0.50

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
SCHEMBL7326990 0.83 F2 (0.71) F2CTRCPRSS2F10
SCHEMBL8541230 0.81 F2 (0.73) F2CTRCPRSS2F10
SCHEMBL8158052 0.79 F2 (0.73) F2CTRCPRSS2F10
SCHEMBL3637680 0.78 F2 (0.69) F2CTRCPRSS2F10
SCHEMBL27533226 0.78 F2 (0.71) F2CTRCPRSS2F10
SCHEMBL5674291 0.77 F2 (0.74) F2CTRCPRSS2F10
SCHEMBL3647138 0.77 F2 (0.71) F2CTRCPRSS2F10
SCHEMBL7392476 0.77 F2 (0.63) F2CTRCPRSS2
SCHEMBL6750719 0.76 F2 (0.73) F2CTRCPRSS2F10
SCHEMBL5673452 0.76 F2 (0.69) F2CTRCPRSS2F10

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-0687253-B1 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1998-12-16 EP disclosed