SCHEMBL8415537

SCHEMBL8415537

C=CC(=O)OCCc1cc2ccccc2c(C(=O)O)c1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.49
ALDH1A1 P00352 6/20 0.46
HSD17B10 Q99714 4/20 0.46
KDM4E B2RXH2 3/20 0.46
HPGD P15428 3/20 0.46
GLA P06280 2/20 0.46
MEN1 O00255 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
KMT2A Q03164 2/20 0.46
ME2 P23368 1/20 0.41
ME1 P48163 1/20 0.41
ME3 Q16798 1/20 0.41
TSHR P16473 5/20 0.38
TP53 P04637 3/20 0.38
HIF1A Q16665 3/20 0.38
HCAR2 Q8TDS4 1/20 0.37
AKR1B10 O60218 3/20 0.35
AKR1B1 P15121 3/20 0.35
CYP3A4 P08684 3/20 0.35

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
SCHEMBL6283658 0.86 THRB (0.50) THRBALDH1A1HSD17B10KDM4EHPGD
SCHEMBL29377001 0.85 THRB (0.41) THRBALDH1A1HSD17B10KDM4EHPGD
SCHEMBL313151 0.80 MEN1 (0.66) ALDH1A1HSD17B10KDM4EHPGDGLA
SCHEMBL14440746 0.80 THRB (0.51) THRBALDH1A1HSD17B10KDM4EHPGD
SCHEMBL4578685 0.79 THRB (0.52) THRBALDH1A1HSD17B10KDM4EHPGD
SCHEMBL6837942 0.78 THRB (0.53) THRBALDH1A1HSD17B10KDM4EHPGD
SCHEMBL29384579 0.78 THRB (0.53) THRBALDH1A1HSD17B10KDM4EMEN1
SCHEMBL68668 0.78 THRB (0.53) THRBALDH1A1HSD17B10KDM4EMEN1
SCHEMBL29503759 0.77 THRB (0.52) THRBALDH1A1HSD17B10KDM4ETSHR
SCHEMBL2880041 0.76 MEN1 (0.56) ALDH1A1HSD17B10KDM4EHPGDGLA

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
EP-0509512-B1 Photosensitive composition for volume hologram recording NIPPON PAINT CO LTD (JP) 1999-08-11 EP disclosed
US-5665494-A CATIONIC AND RADICAL POLYMERIZABLE COMPOUNDS, CYANINE DYE, DIARYLIODINIUM SALT NIPPON PAINT COMPANY, LTD. (JP) 1997-09-09 US disclosed
US-5453340-A Photosensitive composition for volume hologram recording NIPPON PAINT COMPANY, LTD. (JP) 1995-09-26 US disclosed
EP-0509512-A1 Photosensitive composition for volume hologram recording Nippon Paint Co., Ltd. (JP) 1992-10-21 EP disclosed