SCHEMBL566048

SCHEMBL566048

C=CCNc1cc(-c2ccc(O)c(NCC=C)c2)ccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.48
GABRB2 P47870 3/20 0.48
GAA P10253 5/20 0.39
MAPT P10636 4/20 0.39
APP P05067 1/20 0.38
HCAR3 P49019 1/20 0.38
HDAC1 Q13547 6/20 0.38
KDM4E B2RXH2 3/20 0.38
APOBEC3A P31941 1/20 0.38
GFER P55789 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
CA14 Q9ULX7 1/20 0.37
XDH P47989 1/20 0.37
HDAC2 Q92769 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36

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
SCHEMBL564433 0.93 ALOX5 (0.46) GABRA1GABRB2GAAMAPTHDAC1
SCHEMBL565589 0.89 GABRA1 (0.40) GABRA1GABRB2GAAMAPTHCAR3
SCHEMBL565885 0.89 GABRA1 (0.40) GABRA1GABRB2GAAMAPTHCAR3
SCHEMBL565445 0.89 HSD17B1 (0.47) GABRA1GABRB2APPHDAC1KDM4E
Ether SCHEMBL565588 0.89 GABRA1 (0.40) GABRA1GABRB2GAAMAPTHCAR3
SCHEMBL565622 0.85 GABRA1 (0.44) GABRA1GABRB2GAAMAPTAPP
SCHEMBL10588568 0.85 GAA (0.44) GABRA1GABRB2GAAMAPTHCAR3
Ether SCHEMBL565884 0.84 ALOX5 (0.38) GABRA1GABRB2GAAMAPTHDAC1
SCHEMBL9279638 0.81 PRKCI (0.40) GABRA1GABRB2GAAMAPTHCAR3
SCHEMBL796531 0.80 KMT2A (0.48) GAAMAPTKDM4ECA12CA1

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 GABRA1 1019/4885GABRB2 1083/4885GAA 3993/4885

“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.