SCHEMBL17703113

SCHEMBL17703113

c1ccc(-c2cccc3c2oc2c(-c4cccc(N(c5cccc6ccccc56)c5cccc6ccccc56)c4)cccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.38
▸ CYP1A2 P05177 3/20 0.38
▸ CYP1A1 P04798 2/20 0.38
▸ CYP1B1 Q16678 2/20 0.38
▸ PRKDC P78527 7/20 0.36
▸ SIGMAR1 Q99720 2/20 0.36
▸ ALDH1A1 P00352 5/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ PIK3CD O00329 3/20 0.36
▸ PIK3CA P42336 3/20 0.36
▸ PIK3CB P42338 3/20 0.36
▸ PIK3CG P48736 3/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ TP53 P04637 3/20 0.36
▸ TSHR P16473 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ BRD4 O60885 2/20 0.36
▸ BRD2 P25440 2/20 0.36
▸ BRD3 Q15059 2/20 0.36
▸ NFKB1 P19838 2/20 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
SCHEMBL17702956 0.96 ALOX5 (0.37) ALOX5CYP1A2CYP1A1CYP1B1PRKDC
SCHEMBL24751345 0.95 MCL1 (0.39) ALOX5CYP1A2CYP1A1CYP1B1PRKDC
SCHEMBL17703139 0.92 ALOX5 (0.38) ALOX5CYP1A2CYP1A1CYP1B1PRKDC
SCHEMBL19103151 0.91 PRKDC (0.36) ALOX5CYP1A2CYP1A1CYP1B1PRKDC
SCHEMBL17703120 0.91 MCL1 (0.40) ALOX5CYP1A2CYP1A1CYP1B1PRKDC
SCHEMBL29362475 0.91 MCL1 (0.40) ALOX5CYP1A2CYP1A1CYP1B1PRKDC
SCHEMBL17702958 0.91 MCL1 (0.36) ALOX5CYP1A2CYP1A1CYP1B1PRKDC
SCHEMBL24751131 0.90 PRKDC (0.40) ALOX5CYP1A2CYP1A1CYP1B1PRKDC
SCHEMBL17703115 0.89 ALOX5 (0.37) ALOX5CYP1A2PRKDCSIGMAR1ALDH1A1
SCHEMBL17703105 0.88 PRKDC (0.39) ALOX5CYP1A2PRKDCALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210305515-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-09-30 — — US disclosed
US-11050025-B2 Material for organic electroluminescent device and organic electroluminescent device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-29 — — US disclosed
US-9590186-B2 Material for organic electroluminescent device and organic electroluminescent device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-07 — — US disclosed
US-9590186-B2 Material for organic electroluminescent device and organic electroluminescent device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-07 — — US disclosed
US-20160197283-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-07 — — US disclosed
US-20160197283-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-07 — — US disclosed
US-20160118597-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-28 — — US disclosed
US-20160118597-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-28 — — 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 (4 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-20210305515-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME PIEZO1, OCIAD1, L1CAM ALOX5 1625/4885CYP1A2 2052/4885CYP1A1 1452/4885
US-20160197283-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME PIEZO1, OCIAD1, L1CAM ALOX5 1625/4885CYP1A2 2052/4885CYP1A1 1452/4885
US-11050025-B2 Material for organic electroluminescent device and organic electroluminescent device including the same PIEZO1, OCIAD1, L1CAM ALOX5 1625/4885CYP1A2 2052/4885CYP1A1 1452/4885
US-20160118597-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME OR10J3, MCM5, MT-ND5 ALOX5 201/4885CYP1A2 2171/4885CYP1A1 2704/4885

“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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