SCHEMBL18941007

SCHEMBL18941007

Cc1cc(C(c2cc(C)c(O)c(C)c2)c2ccc(O)c(O)c2)cc(C)c1O.Cc1cc(C(c2ccc(O)c(O)c2)c2cc(C)c(O)cc2C)c(C)cc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.39
TRPA1 O75762 1/20 0.39
CACNA1C Q13936 1/20 0.39
KDM4E B2RXH2 8/20 0.36
MAPT P10636 8/20 0.36
HIF1A Q16665 3/20 0.36
HSD17B10 Q99714 3/20 0.36
CYP3A4 P08684 3/20 0.36
MAPK1 P28482 3/20 0.36
HPGD P15428 3/20 0.36
ALOX15 P16050 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
ALOX12 P18054 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
G6PD P11413 1/20 0.36
CYP2C9 P11712 1/20 0.36
PKM P14618 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL13416157 0.91 ALDH1A1 (0.41) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL29373437 0.91 TRPA1 (0.46) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL36188 0.91 TRPA1 (0.46) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL29373036 0.87 TDP1 (0.44) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL36227 0.87 TDP1 (0.44) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL16812643 0.87 ALDH1A1 (0.41) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL17445330 0.82 TP53 (0.46) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL20808844 0.80 ALDH1A1 (0.43) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL5046706 0.80 ESR1 (0.42) PTGS1TRPA1CACNA1CKDM4EMAPT
SCHEMBL8943128 0.80 TDP1 (0.37) PTGS1TRPA1CACNA1CKDM4EMAPT

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-10162260-B2 Photosensitive resin composition, protective film, and liquid crystal display element CHI MEI CORPORATION (TW) 2018-12-25 US disclosed
US-20170168390-A1 PHOTOSENSITIVE RESIN COMPOSITION, PROTECTIVE FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-15 US disclosed