SCHEMBL11788087

SCHEMBL11788087

NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccoc2)cc1Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 7/20 0.53
▸ CA2 P00918 9/20 0.47
▸ CA12 O43570 7/20 0.47
▸ CA1 P00915 7/20 0.47
▸ CA6 P23280 7/20 0.47
▸ CA7 P43166 7/20 0.47
▸ CA14 Q9ULX7 7/20 0.47
▸ CA5A P35218 6/20 0.47
▸ CA9 Q16790 6/20 0.47
▸ CA5B Q9Y2D0 6/20 0.47
▸ CA4 P22748 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ HTR1A P08908 1/20 0.47
▸ HSD11B1 P28845 1/20 0.47
▸ SLC10A1 Q14973 1/20 0.47
▸ GPR35 Q9HC97 1/20 0.47
▸ ABCG2 Q9UNQ0 1/20 0.47
▸ CA3 P07451 6/20 0.44
▸ CA13 Q8N1Q1 6/20 0.44
▸ P2RX4 Q99571 1/20 0.41

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
SCHEMBL11802842 0.92 CISD1 (0.47) CISD1CA2CA12CA1CA6
SCHEMBL11705514 0.88 CISD1 (0.67) CISD1CA2CA12CA1CA6
SCHEMBL11844344 0.86 CISD1 (0.41) CISD1CA2CA12CA1CA6
SCHEMBL11710582 0.84 CISD1 (0.58) CISD1CA2CA12CA1CA6
SCHEMBL11838989 0.83 MEN1 (0.39) CISD1ALDH1A1LMNATSHRCYP2C9
SCHEMBL11056311 0.83 CISD1 (0.69) CISD1CA2CA12CA1CA6
SCHEMBL11709830 0.82 CISD1 (0.62) CISD1CA2CA12CA1CA6
SCHEMBL11790756 0.82 CISD1 (0.58) CISD1CA2CA12CA1CA6
SCHEMBL22515417 0.81 CISD1 (0.73) CISD1CA2CA12CA1CA6
SCHEMBL11708093 0.81 CISD1 (0.69) CISD1CA2CA12CA1CA6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3985777-A Sulphamyl-benzoic acid derivatives LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB (DK) 1976-10-12 — — US claimed
US-3991097-A BORON HYDRIDE OR METAL BOROHYDRIDES AS REDUCING AGENT, LEWIS ACID HOECHST AKTIENGESELLSCHAFT (DT) 1976-11-09 — — US disclosed
US-3985777-A Sulphamyl-benzoic acid derivatives LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB (DK) 1976-10-12 — — US disclosed
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