SCHEMBL12475443

SCHEMBL12475443

COc1cc(/C=C2/NC(=O)NC2=O)cc(OC)c1O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.75
GAA P10253 3/20 0.60
MEN1 O00255 8/20 0.59
KMT2A Q03164 8/20 0.59
IGF1R P08069 1/20 0.57
CLK1 P49759 1/20 0.56
DYRK1A Q13627 1/20 0.56
MAPT P10636 6/20 0.56
POLB P06746 4/20 0.56
HPGD P15428 2/20 0.56
KDM4E B2RXH2 3/20 0.55
BLM P54132 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
TOP1 P11387 1/20 0.55
CISD1 Q9NZ45 1/20 0.55
ALDH1A1 P00352 1/20 0.54
NCOA1 Q15788 1/20 0.54
NCOA3 Q9Y6Q9 1/20 0.54
LMNA P02545 1/20 0.53

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
SCHEMBL9252170 1.00 GSK3B (0.75) GSK3BGAAMEN1KMT2AIGF1R
SCHEMBL9252177 1.00 GSK3B (0.75) GSK3BGAAMEN1KMT2AIGF1R
SCHEMBL15431677 0.91 GSK3B (0.68) GSK3BGAAMEN1KMT2AIGF1R
SCHEMBL13846876 0.90 GSK3B (0.66) GSK3BGAAMEN1KMT2ACLK1
SCHEMBL18475796 0.90 GSK3B (0.66) GSK3BGAAMEN1KMT2AIGF1R
SCHEMBL15421576 0.86 GSK3B (1.00) GSK3BGAAMEN1KMT2ACLK1
SCHEMBL10707263 0.86 GSK3B (1.00) GSK3BGAAMEN1KMT2ACLK1
SCHEMBL9770598 0.86 GSK3B (1.00) GSK3BGAAMEN1KMT2ACLK1
SCHEMBL10095184 0.86 MAPT (0.74) GSK3BGAAMEN1KMT2AIGF1R
SCHEMBL9248800 0.85 TOP1 (0.76) GSK3BGAAMEN1KMT2AIGF1R

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-9896421-B2 Compound having skin-whitening, anti-oxidizing and PPAR activities and medical use thereof PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2018-02-20 US disclosed
US-20160102065-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREOF PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2016-04-14 US disclosed
US-9216148-B2 Compound having skin-whitening, anti-oxidizing and PPAR activities and medical use therefor PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2015-12-22 US disclosed
US-20140023603-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2014-01-23 US disclosed
WO-2012108677-A2 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR 부산대학교 산학협력단 (KR) 2012-08-16 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 (2 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-20140023603-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR PPARG, PPARA, PPARD GSK3B 2733/4885GAA 307/4885MEN1 4685/4885
US-20160102065-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREOF PPARG, PPARA, TYR GSK3B 3223/4885GAA 149/4885MEN1 4838/4885

“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.