SCHEMBL11845025

SCHEMBL11845025

NS(=O)(=O)c1cc(C(=O)O)cc(NCc2ccccc2)c1Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.57
▸ KDM4E B2RXH2 2/20 0.57
▸ USP2 O75604 2/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ HPGD P15428 2/20 0.57
▸ HIF1A Q16665 2/20 0.57
▸ HSD17B10 Q99714 2/20 0.57
▸ CA2 P00918 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ BLM P54132 1/20 0.57
▸ SLC12A2 P55011 1/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57
▸ MRGPRX4 Q96LA9 1/20 0.45
▸ MAPK14 Q16539 1/20 0.45
▸ SLC6A4 P31645 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ CISD1 Q9NZ45 1/20 0.44
▸ AQP1 P29972 1/20 0.43
▸ PRKD3 O94806 1/20 0.43
▸ PRKCG P05129 1/20 0.43

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
SCHEMBL11846114 0.90 KDM4E (0.51) LMNAKDM4EUSP2ALDH1A1HPGD
SCHEMBL11789242 0.88 CA2 (0.71) LMNAKDM4EUSP2ALDH1A1HPGD
Bromide SCHEMBL11378223 0.85 PRKD3 (0.42) LMNAKDM4EUSP2ALDH1A1HPGD
SCHEMBL11850772 0.82 CA2 (0.50) LMNAKDM4EUSP2ALDH1A1HPGD
SCHEMBL11803735 0.82 CA2 (0.63) LMNAKDM4EUSP2ALDH1A1HPGD
SCHEMBL11849257 0.82 CA2 (0.63) LMNAKDM4EUSP2ALDH1A1HPGD
SCHEMBL11849479 0.81 CA2 (0.65) LMNAKDM4EUSP2ALDH1A1HPGD
SCHEMBL11843308 0.81 KDM4E (0.48) LMNAKDM4EUSP2ALDH1A1HPGD
SCHEMBL11842331 0.81 CA2 (0.61) LMNAKDM4EUSP2ALDH1A1HPGD
SCHEMBL11841780 0.80 RXFP1 (0.52) LMNAHPGDCA2RXFP1CISD1

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-3985777-A Sulphamyl-benzoic acid derivatives LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB (DK) 1976-10-12 — — US disclosed
Send feedback