SCHEMBL565583

SCHEMBL565583

C=CCNc1cccc(C(C)(C)c2ccccc2)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.39
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
CYP3A4 P08684 1/20 0.37
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
HIF1A Q16665 1/20 0.34
TSHR P16473 1/20 0.33
CA2 P00918 1/20 0.33
RAB9A P51151 1/20 0.32
HTT P42858 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MITF O75030 1/20 0.32
NSD2 O96028 1/20 0.32
LMNA P02545 1/20 0.32
CASP3 P42574 1/20 0.32

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
SCHEMBL565971 0.90 CA2 (0.37) ALDH1A1KDM4ESMN1; SMN2GAAKMT2A
SCHEMBL565303 0.81 ALDH1A1 (0.40) ALDH1A1KDM4ESMN1; SMN2GAAESR1
SCHEMBL564549 0.78 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2GAAESR1
SCHEMBL564566 0.75 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2GAAESR1
SCHEMBL1276539 0.75 CA2 (0.56) ALDH1A1ESR1ESR2CYP3A4KMT2A
SCHEMBL2363598 0.72 CA2 (0.41) ALDH1A1KDM4ESMN1; SMN2GAAKMT2A
SCHEMBL564626 0.72 GABRA1 (0.48) ALDH1A1KDM4ESMN1; SMN2GAAKMT2A
SCHEMBL8519281 0.70 CCNA2 (0.40) ALDH1A1KDM4ESMN1; SMN2GAACYP3A4
SCHEMBL565964 0.70 ESR1 (0.43) ALDH1A1KDM4ESMN1; SMN2GAAESR1
SCHEMBL442352 0.70 CA2 (0.68) ALDH1A1SMN1; SMN2GAAESR1ESR2

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 204/4885KDM4E 3369/4885SMN1; SMN2 3254/4885

“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.