SCHEMBL17025964

SCHEMBL17025964

[c]1ccc2cccc3c2c1-c1ccccc1O3

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.59
ATM Q13315 2/20 0.59
KDM4E B2RXH2 1/20 0.59
TYMS P04818 2/20 0.46
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CASP1 P29466 2/20 0.34
CASP7 P55210 2/20 0.34
TP53 P04637 1/20 0.34
HPGD P15428 1/20 0.34
HIF1A Q16665 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP3A4 P08684 1/20 0.32
PABPC1 P11940 1/20 0.32
DNMT1 P26358 1/20 0.32
CES2 O00748 1/20 0.31
BCHE P06276 1/20 0.31

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
SCHEMBL17025966 0.77 MAPK1 (0.56) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL26787 0.76 ALDH1A1 (0.56) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL29907833 0.75 MAPK1 (1.00) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL13309034 0.75 MAPK1 (1.00) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL2407346 0.75 ALDH1A1 (0.40) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL24254039 0.74 MAPK1 (0.96) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL24254100 0.73 MAPK1 (0.87) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL19875658 0.72 MAPK1 (0.44) MAPK1ATMKDM4ECYP1A2CYP2D6
SCHEMBL14718854 0.72 ALDH1A1 (0.40) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL454197 0.71 ALDH1A1 (0.61) MAPK1ATMKDM4ETYMSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9871208-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-16 US disclosed
US-20150243908-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-27 US 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-20150243908-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 MAPK1 2576/4885ATM 1334/4885KDM4E 3143/4885

“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.