SCHEMBL17737526

SCHEMBL17737526

c1ccc2c(c1)Oc1cccc3c1c-2cc1c2ccccc2ccc31

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ ALDH1A1 P00352 4/20 0.46
▸ HSD17B10 Q99714 4/20 0.46
▸ HPGD P15428 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ HIF1A Q16665 2/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ HPRT1 P00492 4/20 0.44
▸ CYP1A2 P05177 3/20 0.42
▸ MAOA P21397 2/20 0.42
▸ ERBB2 P04626 1/20 0.42
▸ FYN P06241 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ AHR P35869 1/20 0.42
▸ THRB P10828 1/20 0.41
▸ TYMS P04818 1/20 0.39
▸ CYP2A6 P11509 1/20 0.38

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
SCHEMBL20151723 0.87 ALDH1A1 (0.61) MAPK1KDM4EATMALDH1A1HSD17B10
SCHEMBL15600432 0.80 MAPK1 (0.61) MAPK1KDM4EATMALDH1A1HSD17B10
SCHEMBL17265384 0.80 MAPK1 (0.40) MAPK1KDM4EATMALDH1A1HSD17B10
SCHEMBL2302722 0.80 ALDH1A1 (0.71) MAPK1ATMALDH1A1HSD17B10HPGD
SCHEMBL24923120 0.79 MAPK1 (0.49) MAPK1KDM4EATMALDH1A1HSD17B10
SCHEMBL15600461 0.79 MAPK1 (0.47) MAPK1KDM4EATMALDH1A1HSD17B10
SCHEMBL15600558 0.78 ALDH1A1 (0.46) MAPK1KDM4EATMALDH1A1HSD17B10
SCHEMBL15600574 0.78 ALDH1A1 (0.46) MAPK1KDM4EATMALDH1A1HSD17B10
SCHEMBL15600516 0.77 MAPK1 (0.46) MAPK1KDM4EATMALDH1A1HSD17B10
SCHEMBL19600428 0.77 MAPK1 (0.40) MAPK1KDM4EATMALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210257575-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS SAMSUNG DISPLAY CO., LTD. (KR) 2021-08-19 — — US disclosed
EP-3859809-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS Samsung Display Co., Ltd. (KR) 2021-08-04 — — EP disclosed
US-20190355908-A1 Organic Cocrystal and Applications of the Same HU WENPING (CN) 2019-11-21 — — US disclosed
US-9966543-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-08 — — US disclosed
US-9966543-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-08 — — US disclosed
US-20160133857-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LT.D (KR) 2016-05-12 — — 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 (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-20190355908-A1 Organic Cocrystal and Applications of the Same OTC, SOD1, AOC1 MAPK1 3390/4885KDM4E 2308/4885ATM 1649/4885
US-20160133857-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, OCIAD1, TRPA1 MAPK1 1939/4885KDM4E 3314/4885ATM 1623/4885

“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.

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