SCHEMBL5827166

SCHEMBL5827166

O=[PH](c1ccccc1)c1cc(O)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
POLB P06746 1/20 0.41
GFER P55789 1/20 0.41
ALOX5 P09917 4/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
CA9 Q16790 2/20 0.39
CA14 Q9ULX7 2/20 0.39
PTGS2 P35354 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
USP2 O75604 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
GUSB P08236 1/20 0.37
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.34

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
SCHEMBL1495372 0.79 DBH (0.41) GAAPOLBCA12CA1CA2
Phenol SCHEMBL28189076 0.76 CA12 (0.41) POLBCA12CA1CA2CA7
SCHEMBL27472420 0.74 CA12 (0.48) CA12CA1CA2CA7CA9
Phenol SCHEMBL28034626 0.72 CA12 (0.58) CA12CA1CA2CA7CA9
SCHEMBL29779662 0.72 ALOX5 (0.44) ALOX5CA12CA9ALDH1A1HSP90AA1
SCHEMBL821937 0.71 ALDH1A1 (0.30) ALDH1A1
SCHEMBL28729948 0.69 MMP3 (0.58) ALOX5CA12CA1CA2CA9
SCHEMBL13583073 0.68 ALDH1A1 (0.35) CA12CA1CA2CA7CA9
SCHEMBL1667 0.68 ALDH1A1 (0.35) CA12CA1CA2CA7CA9
Methyl Alcohol SCHEMBL28358130 0.67 CA2 (0.38) CA12CA1CA2CA9CA14

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109287-B2 Space environmentally durable polyimides and copolyimides THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2006-09-19 US disclosed
US-20050137383-A1 Space environmentally durable polyimides and copolyimides U. S. A. AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2005-06-23 US disclosed
US-6841652-B2 Space environmentally durable polyimides and copolyimides THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2005-01-11 US disclosed
US-20030045670-A1 Space environmentally durable polyimides and copolyimides NATIONAL AERONAUTICS AND SPACE ADMINISTRATION 2003-03-06 US disclosed
WO-2002092654-A2 SPACE ENVIRONMENTALLY DURABLE POLYIMIDES AND COPOLYIMIDES THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (NASA) (US) 2002-11-21 WO 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-20030045670-A1 Space environmentally durable polyimides and copolyimides MAGI3, PADI4, PADI3 GAA 3790/4885POLB 2072/4885GFER 629/4885

“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.