SCHEMBL21798699

SCHEMBL21798699

COc1cc(/C=C/C=C/C=C/c2ccc(O)c(OC)c2)ccc1O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.77
TYR P14679 2/20 0.73
TTR P02766 1/20 0.71
NFE2L2 Q16236 3/20 0.69
ALOX5 P09917 3/20 0.67
CYP2D6 P10635 3/20 0.67
CYP1A2 P05177 2/20 0.67
NFKB1 P19838 2/20 0.67
HSD11B1 P28845 2/20 0.67
STAT3 P40763 2/20 0.67
NFKB2 Q00653 2/20 0.67
RELA Q04206 2/20 0.67
TUBB4A P04350 1/20 0.66
TUBB P07437 1/20 0.66
TUBA3C P0DPH7 1/20 0.66
TUBA1B P68363 1/20 0.66
TUBA4A P68366 1/20 0.66
TUBB4B P68371 1/20 0.66
TUBB3 Q13509 1/20 0.66
TUBB2A Q13885 1/20 0.66

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
SCHEMBL4268088 0.93 XDH (0.73) XDHTYRTTRNFE2L2ALOX5
SCHEMBL4268082 0.93 XDH (0.73) XDHTYRTTRNFE2L2ALOX5
SCHEMBL3437056 0.92 XDH (0.88) XDHTYRTTRNFE2L2ALOX5
SCHEMBL17732299 0.90 TTR (0.85) XDHTYRTTRNFE2L2ALOX5
SCHEMBL30807100 0.90 TTR (0.85) XDHTYRTTRNFE2L2ALOX5
SCHEMBL671150 0.90 TTR (0.85) XDHTYRTTRNFE2L2ALOX5
SCHEMBL671149 0.90 TTR (0.85) XDHTYRTTRNFE2L2ALOX5
SCHEMBL4257517 0.89 TYR (0.74) XDHTYRTTRNFE2L2ALOX5
SCHEMBL4257519 0.89 TYR (0.74) XDHTYRTTRNFE2L2ALOX5
SCHEMBL8525744 0.88 XDH (0.67) XDHTYRTTRNFE2L2ALOX5

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
US-11166891-B2 Bis phenyl hexa trien derivatives, preparation method thereof, and composition for skin whitening containing the same as an active ingredient KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2021-11-09 US disclosed
US-11166891-B2 Bis phenyl hexa trien derivatives, preparation method thereof, and composition for skin whitening containing the same as an active ingredient KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2021-11-09 US disclosed
US-20200078279-A1 BIS PHENYL HEXA TRIEN DERIVATIVES, PREPARATION METHOD THEREOF, AND COMPOSITION FOR SKIN WHITENING CONTAINING THE SAME AS AN ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KP) 2020-03-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11166891-B2 Bis phenyl hexa trien derivatives, preparation method thereof, and composition for skin whitening containing the same as an active ingredient TYR, MITF, TPH1 XDH 410/4885TYR 1/4885TTR 614/4885
US-20200078279-A1 BIS PHENYL HEXA TRIEN DERIVATIVES, PREPARATION METHOD THEREOF, AND COMPOSITION FOR SKIN WHITENING CONTAINING THE SAME AS AN ACTIVE INGREDIENT TYR, MITF, TPH1 XDH 410/4885TYR 1/4885TTR 614/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.