SCHEMBL9511892

SCHEMBL9511892

CC(=O)Oc1cc2cc[nH]c2cc1O.Oc1cccc2cc[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.44
KEAP1 Q14145 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
APEX1 P27695 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDPK1 O15530 1/20 0.38
BACE1 P56817 3/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
ADORA3 P0DMS8 2/20 0.35
ADORA2A P29274 2/20 0.35
ADORA1 P30542 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35

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
SCHEMBL1702125 0.88 BACE1 (0.42) KDM4EALDH1A1POLBGAAMAPT
SCHEMBL9442085 0.82 BACE1 (0.42) KDM4EALDH1A1POLBGAAMAPT
SCHEMBL1701759 0.78 CA12 (0.46) KDM4EALDH1A1POLBGAAMAPT
SCHEMBL23646037 0.76 BCHE (0.69) BCHEKEAP1KDM4EALDH1A1POLB
Acetic Acid SCHEMBL23646036 0.76 KEAP1 (0.58) BCHEKEAP1KDM4EALDH1A1BLM
SCHEMBL8609809 0.74 NPSR1 (0.41) KDM4EALDH1A1GAAMAPTBLM
SCHEMBL9413340 0.74 ACHE (0.47) KDM4EALDH1A1POLBBLMKMT2A
SCHEMBL8050935 0.73 ELANE (0.40) KDM4EALDH1A1GAAMAPTBACE1
SCHEMBL27454439 0.73 CSNK2A1 (0.47) KDM4EALDH1A1GAAMAPTKMT2A
SCHEMBL7043680 0.73 TNFSF11 (0.51) POLBMAPTKMT2ABACE1

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
EP-0462883-B1 Keratinous fibres dyeing process with indols, compositions and devices OREAL (FR) 1993-12-15 EP claimed