SCHEMBL18655792

SCHEMBL18655792

OC(COc1ccc(Bc2ccc(OCC3CO3)cc2)cc1)COc1ccc(Bc2ccc(OCC3CO3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 5/20 0.48
TSHR P16473 4/20 0.48
MAPT P10636 4/20 0.48
TP53 P04637 3/20 0.48
HPGD P15428 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
HIF1A Q16665 2/20 0.48
PKM P14618 2/20 0.48
LMNA P02545 2/20 0.48
CYP1A2 P05177 1/20 0.48
PPARG P37231 1/20 0.48
GAA P10253 1/20 0.48
CYP3A4 P08684 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ATM Q13315 1/20 0.38
FGFR1 P11362 1/20 0.37

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
SCHEMBL13886556 0.87 TDP1 (0.63) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL10259735 0.86 TDP1 (0.54) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL15344079 0.86 TDP1 (0.54) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL9446386 0.84 TDP1 (0.51) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL17051339 0.84 TDP1 (0.51) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL16474255 0.81 KMT2A (0.50) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL13527948 0.80 TP53 (0.49) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL71111 0.80 KMT2A (0.78) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL11568438 0.80 KMT2A (0.78) TDP1ALDH1A1TSHRMAPTTP53
SCHEMBL10260317 0.80 ALDH1A1 (0.78) TDP1ALDH1A1TSHRMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180029315-A1 A PROCESS FOR MANUFACTURING A FIBER REINFORCED COMPOSITE ARTICLE, THE COMPOSITE ARTICLE OBTAINED AND THE USE THEREOF HUNTSMAN INTERNATIONAL LLC 2018-02-01 US disclosed
US-20170081487-A1 A PROCESS FOR THE PREPARATION OF A FIBER REINFORCED COMPOSITE ARTICLE, THE COMPOSITE ARTICLES OBTAINED AND THE USE THEREOF HUNTSMAN INTERNATIONAL LLC 2017-03-23 US disclosed