SCHEMBL8031075

SCHEMBL8031075

NS(=O)(=O)c1ccccc1-c1c[c]ncc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 6/20 0.41
FEN1 P39748 6/20 0.41
CA1 P00915 6/20 0.39
CA2 P00918 6/20 0.39
CA9 Q16790 4/20 0.39
CA6 P23280 3/20 0.39
CA4 P22748 2/20 0.39
CA12 O43570 2/20 0.39
CA5A P35218 2/20 0.39
CA7 P43166 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
CYP2C9 P11712 1/20 0.39
CA14 Q9ULX7 1/20 0.39
TRPV1 Q8NER1 2/20 0.36
F10 P00742 3/20 0.36
MAPK1 P28482 1/20 0.36
PTGES2 Q9H7Z7 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
SCHEMBL29442129 0.78 LRRK2 (0.49) ALOX5APFEN1CA1CA2CA9
SCHEMBL1990221 0.78 LRRK2 (0.49) ALOX5APFEN1CA1CA2CA9
SCHEMBL8029103 0.77 FEN1 (0.50) ALOX5APFEN1CA9CA12
SCHEMBL8350056 0.74 CA1 (0.54) ALOX5APFEN1CA1CA2CA9
SCHEMBL16177854 0.73 ALOX5AP (0.48) ALOX5APFEN1CA1CA2CA9
SCHEMBL48885 0.73 CA2 (0.52) ALOX5APFEN1CA1CA2CA9
SCHEMBL1080972 0.72 CA2 (0.61) ALOX5APFEN1CA1CA2CA9
Hydrochloric Acid SCHEMBL6399557 0.71 CA2 (0.50) ALOX5APFEN1CA1CA2CA9
Methane SCHEMBL27503773 0.71 CA2 (0.50) ALOX5APFEN1CA1CA2CA9
SCHEMBL7368182 0.71 ALOX5AP (0.56) ALOX5APFEN1CA1CA2CA9

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-6043257-A ANTICOAGULANT; PYRIDINE SUBSTITUTED INDAZOLE COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-03-28 US disclosed