SCHEMBL2833284

SCHEMBL2833284

c1cc(-c2ccc(OCCCCC3CO3)cc2)ccc1OCCCCC1CO1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.44
TDP1 Q9NUW8 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
ALDH1A1 P00352 3/20 0.41
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 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
SCHEMBL2718081 1.00 HRH3 (0.44) HRH3TDP1HDAC3HDAC4HDAC1
SCHEMBL2720688 0.98 HRH3 (0.42) HRH3TDP1HDAC3HDAC4HDAC1
SCHEMBL2720901 0.98 HRH3 (0.42) HRH3TDP1HDAC3HDAC4HDAC1
SCHEMBL2718715 0.98 HRH3 (0.42) HRH3TDP1HDAC3HDAC4HDAC1
SCHEMBL2719716 0.94 TDP1 (0.44) HRH3TDP1ALDH1A1TP53MAPT
SCHEMBL2836764 0.94 TDP1 (0.44) HRH3TDP1ALDH1A1TP53MAPT
SCHEMBL27670580 0.92 NR5A1 (0.47) HRH3TDP1HDAC3HDAC4HDAC1
SCHEMBL5686926 0.91 HRH3 (0.43) HRH3MEN1KMT2A
SCHEMBL14075174 0.91 NR5A1 (0.50) HRH3HDAC3HDAC4HDAC1HDAC7
SCHEMBL5634063 0.91 GSTP1 (0.40) HRH3HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113563693-B Liquid crystal epoxy resin-mesoporous silica composite material, preparation method and application 中科院广州化学有限公司 2024-03-29 CN disclosed
US-20100160555-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2133380-A1 RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed