SCHEMBL6026912

SCHEMBL6026912

O=C1OC(c2ccccc2)(c2ccc(-c3cc(Cl)co3)cc2)C(O)=C1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
HSP90AA1 P07900 2/20 0.35
TYMS P04818 2/20 0.33
CFTR P13569 1/20 0.33
GOPC Q9HD26 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
ESR1 P03372 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ESR2 Q92731 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GPR55 Q9Y2T6 1/20 0.33
OPRM1 P35372 1/20 0.33

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
SCHEMBL7966642 0.83 CYP1A2 (0.41) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL7971604 0.82 HSP90AA1 (0.35) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL6932601 0.79 CFTR (0.43) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL6026158 0.78 CFTR (0.50) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL6029237 0.77 PIM1 (0.41) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL7955988 0.77 ALDH1A1 (0.37) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL6027636 0.74 ALDH1A1 (0.36) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL7956413 0.74 CFTR (0.39) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL6026268 0.74 CFTR (0.39) ALDH1A1HSP90AA1TYMSCFTRGOPC
SCHEMBL6027361 0.74 HCAR2 (0.38) PGRHCAR3HCAR2

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-7019029-B2 Skin whiteners containing hydroxytetronic acid derivatives THE NORTHWESTERN MUTUAL LIFE INSURANCE COMPANY, AS ADMINISTRATIVE AGENT 2006-03-28 US disclosed
US-20020141956-A1 Skin whiteners containing hydroxytetronic acid derivatives THE NORTHWESTERN MUTUAL LIFE INSURANCE COMPANY, AS ADMINISTRATIVE AGENT 2002-10-03 US disclosed
US-6265436-B1 ANTIINFLAMMATORY AGENTS OXIS THERAPEUTICS INC. 2001-07-24 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 (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-20020141956-A1 Skin whiteners containing hydroxytetronic acid derivatives TYR, PPP6C, CYP26A1 ALDH1A1 55/4885HSP90AA1 677/4885TYMS 1339/4885

“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.