SCHEMBL27587745

SCHEMBL27587745

NS(=O)(=O)c1ccc2ccc[c]c2n1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.35
CA1 P00915 7/20 0.35
CA9 Q16790 6/20 0.35
CA12 O43570 3/20 0.35
CA4 P22748 2/20 0.35
CA7 P43166 2/20 0.35
CA14 Q9ULX7 2/20 0.35
LMNA P02545 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
MAPK1 P28482 1/20 0.32

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
SCHEMBL3282411 0.71 NCF1 (0.45) CA5A
SCHEMBL645967 0.69 NCF1 (0.48) CA2CA1CA9CA12CA4
SCHEMBL1071858 0.69 CYP1A2 (0.46) LMNA
SCHEMBL27643307 0.68 CYP1A2 (0.42)
Hydrochloric Acid SCHEMBL28093520 0.68 NCF1 (0.47) CA2CA1CA9CA12CA4
SCHEMBL19329369 0.68 PIM1 (0.49) LMNA
SCHEMBL4851470 0.67 CYP3A4 (0.30)
SCHEMBL4358400 0.67 METAP2 (0.31)
SCHEMBL16049760 0.67
SCHEMBL3955189 0.67 CYP2A6 (0.33)

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
CN-1539816-A IL-8 receptor antagonists ʷ��˿�������ȳ�ķ���޹�˾ 2004-10-27 CN disclosed