SCHEMBL9698733

SCHEMBL9698733

Cc1cc(=O)n(CC(=O)O)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
ALDH1A1 P00352 8/20 0.44
KDM4E B2RXH2 7/20 0.44
MAPT P10636 7/20 0.44
KMT2A Q03164 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
LMNA P02545 2/20 0.42
ENPP3 O14638 2/20 0.41
ALPL P05186 2/20 0.41
XIAP P98170 2/20 0.41
POLB P06746 2/20 0.41
MEN1 O00255 3/20 0.40
GAA P10253 2/20 0.40
HTT P42858 2/20 0.40
KDM5A P29375 1/20 0.39
KDM2B Q8NHM5 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37

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
SCHEMBL11783166 0.83 L3MBTL1 (0.44) L3MBTL1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL9697614 0.81 KMT2A (0.57) L3MBTL1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL10903062 0.77 ALKBH5 (0.44) ALDH1A1KMT2ASMN1; SMN2LMNAMEN1
SCHEMBL4334782 0.76 GAA (0.45) L3MBTL1ALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL6850809 0.75
SCHEMBL695678 0.75 L3MBTL1 (0.48) L3MBTL1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL11440668 0.75 ALDH1A1 (0.49) L3MBTL1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL6005236 0.74 L3MBTL1 (0.54) L3MBTL1ALDH1A1KDM4EMAPTKMT2A
Acetic Acid SCHEMBL11685351 0.74 L3MBTL1 (0.57) L3MBTL1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL11751479 0.72 L3MBTL1 (0.56) L3MBTL1ALDH1A1KDM4EMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5116957-A REACTIVE AZO DYESTUFFS HAVING A FLUOROTRIAZINE GROUP AND IMPROVED FIXATION PROPERTIES BAYER AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed
EP-0088930-B1 TRIAZOLE-TRIAZINYL AZO DYES BAYER AG (DE) 1986-04-09 EP disclosed
US-4556707-A DYEING CELLULOSE FIBERS AND POLYAMIDE FIBERS BAYER AKTIENGESELLSCHAFT (DE) 1985-12-03 US disclosed
US-4540776-A Reactive fluorotriazinylaminonaphthotriazolyphenylazopyridone or pyrimidone dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1985-09-10 US disclosed
EP-0120255-A1 Reactive dyes BAYER AG (DE) 1984-10-03 EP disclosed
EP-0088930-A2 Triazole-triazinyl azo dyes BAYER AG (DE) 1983-09-21 EP disclosed
US-4354968-A Azo reactive dyestuffs having an aryl-triazinyl-aryl diazo component BAYER AKTIENGESELLSCHAFT (DE) 1982-10-19 US disclosed
US-4218432-A Coloring agent and a composition including the same for coloring toilet bowl flushing water YAMAMOTO KAGAKU GOSEI CO., LTD. (JP) 1980-08-19 US disclosed
EP-0013879-A1 Reactive dyestuffs, their preparation and their use for dyeing materials containing hydroxyl or amide groups BAYER AG (DE) 1980-08-06 EP disclosed
US-3988310-A FIBER-REACTIVE DYES; CELLULOSE BAYER AKTIENGESELLSCHAFT (DT) 1976-10-26 US disclosed
US-3966703-A Asymmetrical frisazo dyestuffs derived from diazotized 2,7-diamino-carbazole BAYER AKTIENGESELLSCHAFT (DT) 1976-06-29 US disclosed