SCHEMBL8049060

SCHEMBL8049060

CCc1cc(=O)[nH]c2cc([NH])ccc12

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 3/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 3/20 0.41
GLA P06280 2/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL8064223 0.80 KDM4E (0.62) SMN1; SMN2GAAALDH1A1KDM4EGLA
SCHEMBL12668286 0.79 ALDH1A1 (0.67) ARSMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL8049063 0.79 AR (0.55) ARSMN1; SMN2GAAGRIN2DGRIN3B
SCHEMBL12667324 0.77 KDM4E (0.69) SMN1; SMN2GAAALDH1A1KDM4EGLA
SCHEMBL1771514 0.77 CYP1A2 (0.63) SMN1; SMN2GAAALDH1A1KDM4EHPGD
SCHEMBL12119275 0.72 KDM4E (0.53) SMN1; SMN2GAAGRIN2DGRIN3BGRIN1
SCHEMBL8061726 0.71 HPGD (0.67) SMN1; SMN2ALDH1A1KDM4EHPGDKMT2A
SCHEMBL1770840 0.69 AR (0.55) ARGAAGRIN2DGRIN3BGRIN1
SCHEMBL12668289 0.69 ALDH1A1 (0.61) ARSMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL8785295 0.68 GRIN2D (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
EP-0838504-B1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DYSTAR TEXTILFARBEN GMBH & CO (DE) 2000-06-07 EP disclosed
US-5834601-A DYEING CELLULOSE, WOOL, POLYAMIDE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-11-10 US disclosed
EP-0838504-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1998-04-29 EP disclosed