SCHEMBL29904657

SCHEMBL29904657

Oc1cc(Cl)c(O)c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.56
LMNA P02545 2/20 0.56
THRB P10828 1/20 0.50
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 3/20 0.48
MAPT P10636 3/20 0.48
KMT2A Q03164 3/20 0.48
NSD2 O96028 1/20 0.48
POLB P06746 1/20 0.48
MCL1 Q07820 1/20 0.48
TRPM4 Q8TD43 1/20 0.48
IDO1 P14902 1/20 0.48
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 4/20 0.47
HPGD P15428 2/20 0.47
PKM P14618 1/20 0.47
CYP3A4 P08684 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALOX15B O15296 1/20 0.42
NR1I2 O75469 1/20 0.42

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
SCHEMBL30499578 1.00 HTT (0.56) HTTLMNATHRBKDM4EMEN1
SCHEMBL588770 1.00 HTT (0.56) HTTLMNATHRBKDM4EMEN1
SCHEMBL553501 0.83 ALDH1A1 (0.59) HTTLMNAKDM4EMEN1MAPT
SCHEMBL9618923 0.81 IDO1 (0.50) HTTLMNATHRBKDM4EMEN1
SCHEMBL27497018 0.80 ALDH1A1 (0.43) HTTLMNATHRBKDM4EMEN1
SCHEMBL15961769 0.79 HSD17B10 (0.50) HTTLMNAMEN1MAPTKMT2A
SCHEMBL1803989 0.78 HSD17B10 (0.61) HTTTHRBKDM4EMEN1MAPT
SCHEMBL11153750 0.77 HTT (0.52) HTTLMNAKDM4EMEN1MAPT
SCHEMBL21771152 0.77 ALDH1A1 (0.49) HTTLMNAKDM4EMEN1MAPT
SCHEMBL6537307 0.77 EP300 (0.46) HTTLMNAKDM4EMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115252588-B Application of 1, 4-hydroquinone and/or 1, 4-hydroquinone derivative in preparing anti-novel coronavirus medicine 山东达因海洋生物制药股份有限公司 2024-02-02 CN claimed
CN-115252588-A Application of 1, 4-hydroquinone and/or 1, 4-hydroquinone derivative in preparation of anti-novel coronavirus medicines 山东达因海洋生物制药股份有限公司 2022-11-01 CN claimed
CN-115252588-B Application of 1, 4-hydroquinone and/or 1, 4-hydroquinone derivative in preparing anti-novel coronavirus medicine 山东达因海洋生物制药股份有限公司 2024-02-02 CN disclosed
CN-115252588-A Application of 1, 4-hydroquinone and/or 1, 4-hydroquinone derivative in preparation of anti-novel coronavirus medicines 山东达因海洋生物制药股份有限公司 2022-11-01 CN disclosed