SCHEMBL22837460

SCHEMBL22837460

c1ccc(-c2cccc3c2oc2c(N(c4ccc(-c5cccc6ccccc56)cc4)c4cccc(-c5cccc6cccc(-c7ccccc7)c56)c4)cccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.37
▸ ACMSD Q8TDX5 1/20 0.37
▸ ALOX5 P09917 1/20 0.34
▸ CA12 O43570 2/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ CYP1A2 P05177 2/20 0.32
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32
▸ ENPP1 P22413 2/20 0.32
▸ ENPP3 O14638 1/20 0.32
▸ CHRNB4 P30926 2/20 0.32
▸ CHRNA3 P32297 2/20 0.32
▸ CHRNA7 P36544 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ TP53 P04637 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ NFKB1 P19838 2/20 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
SCHEMBL22837524 0.92 ALOX5 (0.40) MCL1ACMSDALOX5CA12CA1
SCHEMBL17703120 0.91 MCL1 (0.40) MCL1ACMSDALOX5CA12CA1
SCHEMBL29362475 0.91 MCL1 (0.40) MCL1ACMSDALOX5CA12CA1
SCHEMBL17703149 0.90 ENPP3 (0.38) MCL1ACMSDALOX5CA12CA1
SCHEMBL27334347 0.90 CYP1A1 (0.39) MCL1ACMSDCA12CA1CA2
SCHEMBL26753130 0.89 ALDH1A1 (0.36) MCL1ACMSDALOX5CA12CA1
SCHEMBL24944602 0.89 PRKDC (0.36) ALOX5CA12CA1CA2CA9
SCHEMBL19103123 0.89 MCL1 (0.38) MCL1ACMSDALOX5CA12CA1
SCHEMBL24945261 0.89 PRKDC (0.36) ALOX5CA12CA1CA2CA9
SCHEMBL26588805 0.89 ALOX5 (0.43) MCL1ACMSDALOX5CA12CA1

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-11716901-B2 Organic electroluminescence device and amine compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-01 — — US disclosed
US-11716901-B2 Organic electroluminescence device and amine compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-01 — — US disclosed
EP-3401313-B1 AMINE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2021-04-07 — — EP disclosed
US-20210066597-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-03-04 — — US disclosed
US-10879471-B2 Organic electroluminescence device and amine compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-29 — — 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 (3 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-11716901-B2 Organic electroluminescence device and amine compound for organic electroluminescence device L1CAM, AOC2, AOC3 MCL1 2871/4885ACMSD 2436/4885ALOX5 3112/4885
US-10879471-B2 Organic electroluminescence device and amine compound for organic electroluminescence device L1CAM, AOC2, AOC3 MCL1 2871/4885ACMSD 2436/4885ALOX5 3112/4885
US-20210066597-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE L1CAM, AOC2, AOC3 MCL1 2871/4885ACMSD 2436/4885ALOX5 3112/4885

“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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