SCHEMBL3817427

SCHEMBL3817427

CCCCCCCc1cc(C2(c3ccc(O)c(CCCCCCC)c3)CCC(c3ccc(O)cc3)CC2)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.44
CYP3A4 P08684 2/20 0.44
TYR P14679 2/20 0.44
MEN1 O00255 1/20 0.44
ALOX5 P09917 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ESR2 Q92731 6/20 0.42
SPHK1 Q9NYA1 5/20 0.40
ESR1 P03372 6/20 0.38
ADRA2A P08913 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
TACR2 P21452 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38

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
SCHEMBL3816725 0.95 ESR2 (0.43) TP53CYP3A4TYRMEN1ALOX5
SCHEMBL3812675 0.85 ESR2 (0.48) CYP3A4ESR2ESR1
SCHEMBL2718788 0.84 TP53 (0.51) TP53CYP3A4TYRMEN1ALOX5
SCHEMBL2721546 0.84 TP53 (0.51) TP53CYP3A4TYRMEN1ALOX5
SCHEMBL2718706 0.84 TP53 (0.51) TP53CYP3A4TYRMEN1ALOX5
SCHEMBL9075191 0.83 ESR1 (0.56) TP53CYP3A4ESR2SPHK1ESR1
SCHEMBL9073983 0.83 ESR1 (0.56) TP53CYP3A4ESR2SPHK1ESR1
SCHEMBL9075573 0.83 ESR1 (0.56) TP53CYP3A4ESR2SPHK1ESR1
SCHEMBL2720022 0.82 CYP3A4 (0.49) TP53CYP3A4TYRMEN1ALOX5
SCHEMBL9279382 0.82 ESR1 (0.54) TP53CYP3A4ESR2SPHK1ESR1

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-1375461-B1 DIPHENOL AND PROCESS FOR PRODUCING THE SAME HONSHU CHEMICAL IND (JP) 2009-08-05 EP disclosed
US-6872858-B2 Diphenol and process for producing the same HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2005-03-29 US disclosed
US-20040049086-A1 Diphenol and process for producing the same HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2004-03-11 US disclosed
EP-1375461-A1 DIPHENOL AND PROCESS FOR PRODUCING THE SAME Honshu Chemical Industry Co. Ltd. (JP) 2004-01-02 EP 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 (1 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-20040049086-A1 Diphenol and process for producing the same CYP1A1, AHR, CYP2E1 TP53 3303/4885CYP3A4 44/4885TYR 377/4885

“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.