SCHEMBL10963208

SCHEMBL10963208

NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccccc2)cc1Nc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 5/20 0.70
▸ CA12 O43570 10/20 0.57
▸ CA1 P00915 10/20 0.57
▸ CA2 P00918 10/20 0.57
▸ CA9 Q16790 9/20 0.57
▸ CA6 P23280 8/20 0.57
▸ CA7 P43166 8/20 0.57
▸ CA14 Q9ULX7 8/20 0.57
▸ CA3 P07451 7/20 0.57
▸ CA13 Q8N1Q1 7/20 0.57
▸ CA5B Q9Y2D0 7/20 0.57
▸ CA5A P35218 7/20 0.57
▸ JAK3 P52333 2/20 0.51
▸ IRAK4 Q9NWZ3 2/20 0.51
▸ JAK2 O60674 1/20 0.51
▸ JAK1 P23458 1/20 0.51
▸ TYK2 P29597 1/20 0.51
▸ CA4 P22748 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ HTR1A P08908 1/20 0.49

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
SCHEMBL11198982 0.92 CISD1 (0.64) CISD1CA12CA1CA2CA9
SCHEMBL1716052 0.82 CISD1 (1.00) CISD1CA12CA1CA2CA9
SCHEMBL11874599 0.81 CISD1 (0.72) CISD1CA12CA1CA2CA9
SCHEMBL11790092 0.81 CISD1 (0.70) CISD1CA12CA1CA2CA9
SCHEMBL12418658 0.80 CISD1 (0.81) CISD1CA12CA1CA2CA9
SCHEMBL11778816 0.80 CISD1 (0.48) CISD1CA12CA1CA2CA9
SCHEMBL11705514 0.79 CISD1 (0.67) CISD1CA12CA1CA2CA9
SCHEMBL10962539 0.78 CISD1 (0.66) CISD1CA12CA1CA2CA9
SCHEMBL11780949 0.77 CISD1 (0.46) CISD1CA12CA1CA2CA9
SCHEMBL11841241 0.77 CISD1 (0.53) CISD1CA12CA1CA2CA9

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-0056970-B1 ANTHRANILIC ACIDS SUBSTITUTED BY BASIC GROUPS, PROCESS FOR THEIR PREPARATION AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1985-03-27 — — EP disclosed
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