SCHEMBL565060

SCHEMBL565060

Nc1ccc(Cc2ccc(O)c(N)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
CYP3A4 P08684 3/20 0.58
TSHR P16473 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
GAA P10253 4/20 0.57
KDM4E B2RXH2 1/20 0.57
MEN1 O00255 1/20 0.57
POLB P06746 1/20 0.57
MAPT P10636 1/20 0.57
RAB9A P51151 1/20 0.57
KMT2A Q03164 1/20 0.57
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
IDH1 O75874 1/20 0.48
GFER P55789 2/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
ALOX12 P18054 2/20 0.44

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
SCHEMBL564615 0.91 GAA (0.67) ALDH1A1CYP3A4GAAKDM4EMEN1
SCHEMBL29412587 0.91 GAA (0.67) ALDH1A1CYP3A4GAAKDM4EMEN1
SCHEMBL29860720 0.91 GAA (0.67) ALDH1A1CYP3A4GAAKDM4EMEN1
Hydrochloric Acid SCHEMBL21173959 0.89 GAA (0.64) ALDH1A1CYP3A4TDP1GAAKDM4E
SCHEMBL564633 0.88 ESR1 (0.58) ALDH1A1CYP3A4GAAKDM4EMEN1
SCHEMBL564652 0.86 IDH1 (0.68) ALDH1A1CYP3A4GAAKDM4EMEN1
SCHEMBL29350695 0.86 IDH1 (0.68) ALDH1A1CYP3A4GAAKDM4EMEN1
SCHEMBL21011238 0.85 CA1 (0.74) ALDH1A1CYP3A4TSHRTDP1GAA
SCHEMBL20132138 0.84 ALDH1A1 (0.61) ALDH1A1TDP1GAAKDM4EMEN1
SCHEMBL8514724 0.83 GAA (0.83) ALDH1A1CYP3A4TDP1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8674029-B2 Method of preparing stabilized polymeric systems using polymeric peroxides Sunocs LLC (US) 2014-03-18 US disclosed
US-20120035307-A1 PROCESS FOR MAKING STABLIZED POLYMERIC SYSTEMS WITH NANOSTRUCTURES SONG CHENGQIAN (US) 2012-02-09 US disclosed
US-20120035315-A1 METHOD OF PREPARING STABLIZED POLYMERIC SYSTEMS USING POLYMERIC PEROXIDES SONG CHENGQIAN (US) 2012-02-09 US disclosed
US-7498467-B2 Antioxidant and bisaminophenol derivative IDEMITSU KOSAN CO., LTD. (JP) 2009-03-03 US disclosed
US-20080161608-A1 ANTIOXIDANT AND BISAMINOPHENOL DERIVATIVE IDEMITSU KOSAN CO., LTD. (JP) 2008-07-03 US disclosed
US-20060208227-A1 Antioxidant and bisaminophenol derivative IDEMITSU LOSAN CO., LTD (JP) 2006-09-21 US disclosed
EP-1612254-A1 ANTIOXIDANT AND BISAMINOPHENOL DERIVATIVE IDEMITSU KOSAN COMPANY LIMITED (JP) 2006-01-04 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-20080161608-A1 ANTIOXIDANT AND BISAMINOPHENOL DERIVATIVE CBR1, CBR3, HMOX1 ALDH1A1 204/4885CYP3A4 360/4885TSHR 2375/4885

“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.