SCHEMBL1900241

SCHEMBL1900241

C=Cc1ccccc1C(=O)OCc1cccc(O)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.50
ALDH1A1 P00352 2/20 0.48
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
STAT1 P42224 1/20 0.44
NPC1 O15118 1/20 0.44
CYP3A4 P08684 2/20 0.43
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
TYR P14679 1/20 0.40

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
SCHEMBL1897802 0.87 ALDH1A1 (0.63) TDP1ALDH1A1RAB9ACYP3A4TSHR
SCHEMBL4371870 0.76 CYP3A4 (0.50) TDP1ALDH1A1RAB9AKDM4ENPC1
SCHEMBL29030397 0.76 CYP3A4 (0.53) TDP1ALDH1A1RAB9ANPC1CYP3A4
SCHEMBL10499320 0.74 CYP3A4 (0.51) TDP1ALDH1A1NPC1CYP3A4TSHR
SCHEMBL30385424 0.74 TSHR (0.67) TDP1ALDH1A1KDM4ECYP3A4TSHR
SCHEMBL6551356 0.74 CYP3A4 (0.77) ALDH1A1KDM4EGAANPC1CYP3A4
SCHEMBL2002577 0.74 TSHR (0.67) TDP1ALDH1A1KDM4ECYP3A4TSHR
SCHEMBL1898363 0.74 HCAR2 (0.48) LMNATYR
SCHEMBL6953191 0.74 ALDH1A1 (0.47) TDP1ALDH1A1RAB9AKDM4EGAA
SCHEMBL1131579 0.73 TDP1 (0.55) TDP1ALDH1A1RAB9ANPC1TSHR

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-20110198730-A1 HYPERBRANCHED POLYMER SYNTHESIZING METHOD, HYPERBRANCHED POLYMER, RESIST COMPOSITION, SEMICONDUCTOR INTEGRATED CIRCUIT, AND SEMICONDUCTOR INTEGRATED CIRCUIT FABRICATION METHOD LION CORPORATION 2011-08-18 US disclosed
US-20110101503-A1 HYPERBRANCHED POLYMER SYNTHESIZING METHOD, HYPERBRANCHED POLYMER, RESIST COMPOSITION, SEMICONDUCTOR INTEGRATED CIRCUIT, AND SEMICONDUCTOR INTEGRATED CIRCUIT FABRICATION METHOD LION CORPORATION (JP) 2011-05-05 US disclosed