SCHEMBL6094411

SCHEMBL6094411

CCOCOc1ccc(NC(=O)O)cc1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
KMT2A Q03164 5/20 0.50
MEN1 O00255 3/20 0.50
ALDH1A1 P00352 5/20 0.49
RAB9A P51151 2/20 0.49
NPC1 O15118 2/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
TP53 P04637 2/20 0.45
KDM4E B2RXH2 2/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
RORC P51449 1/20 0.42
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPK1 P28482 1/20 0.41
HPGD P15428 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL6096438 0.83 MAPT (0.44) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL9996831 0.77 MAPT (0.51) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL7961633 0.74 TDP1 (0.56) MAPTKMT2AALDH1A1RAB9ANPC1
SCHEMBL10781794 0.73 TDP1 (0.49) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL10777343 0.73 TDP1 (0.55) MAPTKMT2AMEN1RAB9ANPC1
SCHEMBL5889010 0.73 ALDH1A1 (0.44) MAPTKMT2AALDH1A1RAB9ASMN1; SMN2
SCHEMBL8119312 0.72 CYP1A2 (0.57) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL6160971 0.71 EPHX2 (0.55) MAPTKMT2AMEN1ALDH1A1POLB
SCHEMBL2886975 0.70 ALDH1A1 (0.56) MAPTKMT2AMEN1ALDH1A1RAB9A
SCHEMBL10975098 0.70 SMN1; SMN2 (0.49) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2

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-7070626-B2 (P-amino-hydroxyphenyl)-acrylamide derivatives and dyes containing said compounds WELLA AG (DE) 2006-07-04 US disclosed