SCHEMBL11846740

SCHEMBL11846740

Nc1cc(C(=O)O)cc(S(=O)(=O)Nc2ccccc2)c1Nc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2B Q14289 1/20 0.56
▸ MAPT P10636 3/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ GAA P10253 3/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ HTT P42858 1/20 0.47
▸ TSHR P16473 1/20 0.45
▸ WDR5 P61964 2/20 0.44
▸ FABP4 P15090 1/20 0.43
▸ FABP5 Q01469 1/20 0.43
▸ POLB P06746 2/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ GFER P55789 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ ATIC P31939 1/20 0.43
▸ CYP2C19 P33261 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
SCHEMBL11783471 0.86 MEN1 (0.53) MAPTHSD17B10GAAKDM4EALDH1A1
SCHEMBL2883310 0.86 KDM4E (0.52) PTK2BMAPTHSD17B10GAAKDM4E
SCHEMBL11780330 0.81 MEN1 (0.47) MAPTGAAHTTTSHRPOLB
SCHEMBL11852448 0.80 HCAR3 (0.54) PTK2BMAPTKDM4EALDH1A1POLB
SCHEMBL11850140 0.78 CDC25B (0.46) MAPTHSD17B10GAAKDM4EALDH1A1
SCHEMBL11841803 0.78 L3MBTL1 (0.50) PTK2BMAPTHSD17B10ALDH1A1HPGD
SCHEMBL11778072 0.76 CA1 (0.46) MAPTGAAKDM4EPOLBMEN1
SCHEMBL11784962 0.76 L3MBTL1 (0.46) PTK2BMAPTHSD17B10ALDH1A1HPGD
SCHEMBL11846780 0.76 CDC25B (0.41) MAPTHSD17B10GAAKDM4EALDH1A1
SCHEMBL11850356 0.75 WDR5 (0.44) MAPTHSD17B10GAAKDM4EALDH1A1

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
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