SCHEMBL8990107

SCHEMBL8990107

COc1cc(N)c(S(=O)(=O)O)cc1NC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL27356868 0.88 KDM4E (0.41) ALDH1A1MEN1KMT2A
SCHEMBL8427207 0.86 ALDH1A1 (0.51) ALDH1A1MEN1KMT2A
SCHEMBL11117676 0.83 MEN1 (0.54) ALDH1A1MEN1KMT2A
SCHEMBL1939964 0.83 NPC1 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL11877092 0.82 MEN1 (0.55) ALDH1A1MEN1KMT2A
SCHEMBL10782416 0.82 PKM (0.47) ALDH1A1MEN1KMT2A
SCHEMBL392265 0.81 SMN1; SMN2 (0.49) ALDH1A1MEN1KMT2A
SCHEMBL8590961 0.81 MEN1 (0.58) ALDH1A1MEN1KMT2A
SCHEMBL7778665 0.81 ALDH1A1 (0.48) ALDH1A1MEN1KMT2A
SCHEMBL10535182 0.80 NPC1 (0.44) ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35359-E Amine salts of azo pigments based on pyrazolone derivatives CIBA-GEIGY CORPORATION (US) 1996-10-22 US disclosed
EP-0241413-B1 AMINE SALTS OF AZO COMPOUNDS CIBA-GEIGY AG (CH) 1993-03-03 EP disclosed
US-5151505-A Monoazo dyes containing hydroxypyrazole groups CIBA-GEIGY CORPORATION (US) 1992-09-29 US disclosed
US-4992495-A Yellow pigment CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed
EP-0241413-A2 Amine salts of azo compounds CIBA-GEIGY AG (CH) 1987-10-14 EP disclosed
US-4118232-A Photographic material containing sulphonic acid group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1978-10-03 US disclosed
US-4051123-A Sulfonic-acid-group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1977-09-27 US disclosed
US-3960831-A WET FASTNESS, COLORFASTNESS BAYER AKTIENGESELLSCHAFT (DT) 1976-06-01 US disclosed