SCHEMBL11838101

SCHEMBL11838101

CCOC(=O)c1cc(NCc2ccccc2)c(Nc2cccc(C)c2)c(S(N)(=O)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.44
▸ AURKB Q96GD4 2/20 0.43
▸ MAPT P10636 4/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ AURKA O14965 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SENP1 Q9P0U3 1/20 0.41
▸ CDC25B P30305 3/20 0.41
▸ CISD1 Q9NZ45 1/20 0.41
▸ TP53 P04637 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ NAMPT P43490 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA3 P07451 1/20 0.40

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
SCHEMBL11843963 0.93 ALOX15 (0.48) ALOX15AURKBMAPTAURKASMN1; SMN2
SCHEMBL11843783 0.91 ALOX15 (0.46) ALOX15MAPTSMN1; SMN2SENP1CISD1
SCHEMBL11849129 0.90 MAPT (0.46) ALOX15AURKBMAPTAURKASMN1; SMN2
SCHEMBL11853481 0.90 MAPT (0.49) ALOX15MAPTL3MBTL1SMN1; SMN2NPC1
SCHEMBL11855966 0.89 CISD1 (0.47) MAPTL3MBTL1NPC1RECQLRAB9A
SCHEMBL11840275 0.89 RXFP1 (0.47) ALOX15MAPTTP53NPSR1RXFP1
SCHEMBL11846270 0.88 ALOX15 (0.44) ALOX15MAPTSMN1; SMN2SENP1CDC25B
SCHEMBL11854968 0.87 CISD1 (0.45) ALOX15MAPTSMN1; SMN2CISD1TP53
SCHEMBL11852452 0.87 ALOX15 (0.46) ALOX15MAPTSMN1; SMN2CISD1TP53
SCHEMBL11843685 0.86 MAPT (0.44) ALOX15MAPTL3MBTL1SMN1; SMN2CISD1

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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