SCHEMBL23635375

SCHEMBL23635375

CCCCCCCc1cc(-c2ccc(O)cc2)ccc1-c1ccc(OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.50
MGLL Q99685 5/20 0.47
ALOX5 P09917 5/20 0.46
TP53 P04637 3/20 0.46
CYP3A4 P08684 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
TYR P14679 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PTGS2 P35354 5/20 0.45
CALM1 P0DP23 1/20 0.44
NR5A1 Q13285 1/20 0.44
ESR1 P03372 3/20 0.44
CYP19A1 P11511 1/20 0.44
ADRA2A P08913 2/20 0.43
ADORA3 P0DMS8 2/20 0.43

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
SCHEMBL19854382 0.93 MGLL (0.46) MGLLALOX5PTGS2CASP3SENP8
SCHEMBL19854457 0.90 TP53 (0.54) MGLLALOX5TP53CYP3A4MEN1
SCHEMBL19854385 0.90 TP53 (0.54) MGLLALOX5TP53CYP3A4MEN1
SCHEMBL20407680 0.90 ALOX5 (0.46) MGLLALOX5TP53CYP3A4MEN1
SCHEMBL20407416 0.89 CYP3A4 (0.51) ESR2MGLLALOX5TP53CYP3A4
SCHEMBL10438718 0.83 ALOX5 (0.60) ESR2ALOX5TP53CYP3A4MEN1
SCHEMBL21322010 0.82 CASP3 (0.50) MEN1MAPTALOX15TSHRKMT2A
SCHEMBL19854383 0.81 CYP3A4 (0.53) TP53CYP3A4MEN1TSHRKMT2A
SCHEMBL27370794 0.81 MGLL (0.48) MGLLALOX5TP53CYP3A4MEN1
SCHEMBL21321754 0.80 CASP3 (0.51) MEN1MAPTALOX15KMT2AALDH1A1

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-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 US disclosed