SCHEMBL21883741

SCHEMBL21883741

Cc1c(O)cc(O)c(C)c1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.50
CYP3A4 P08684 5/20 0.42
SELL P14151 1/20 0.36
SELP P16109 1/20 0.36
SELE P16581 1/20 0.36
ALDH1A1 P00352 6/20 0.35
MAPT P10636 4/20 0.35
KDM4E B2RXH2 4/20 0.35
HPGD P15428 4/20 0.35
GAA P10253 3/20 0.35
MAPK1 P28482 2/20 0.35
HTT P42858 2/20 0.35
BLM P54132 2/20 0.35
NSD2 O96028 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
CASP6 P55212 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTPN1 P18031 1/20 0.35
TP53 P04637 3/20 0.34

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
SCHEMBL2471296 0.86 ACHE (0.43) ACHECYP3A4SELLSELPSELE
SCHEMBL10434111 0.86 ACHE (0.43) ACHECYP3A4SELLSELPSELE
SCHEMBL25581857 0.81 ACHE (0.43) ACHECYP3A4SELLSELPSELE
SCHEMBL28498022 0.80 ACHE (0.43) ACHECYP3A4ALDH1A1MAPTKDM4E
SCHEMBL6027776 0.78 CA1 (0.42) ACHECYP3A4SELLSELPSELE
SCHEMBL68071 0.76 ACHE (0.59) ACHECYP3A4SELLSELPSELE
SCHEMBL9744264 0.75 ACHE (0.58) ACHECYP3A4SELLSELPSELE
SCHEMBL24803322 0.75 ALDH1A1 (0.50) ACHECYP3A4ALDH1A1MAPTKDM4E
SCHEMBL30761078 0.75 ALDH1A1 (0.50) ACHECYP3A4ALDH1A1MAPTKDM4E
SCHEMBL658795 0.75 ACHE (0.43) ACHECYP3A4SELLSELPSELE

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
WO-2020071798-A1 COMPOUND, COLORED RESIN COMPOSITION, COLOR FILTER, AND DISPLAY DEVICE 동우 화인켐 주식회사 2020-04-09 WO disclosed