SCHEMBL21453984

SCHEMBL21453984

c1ccc(-n2c3ccccc3c3cc4c5cccnc5n(-c5cccc(-c6cccc(-n7c8ccccc8c8ccccc87)c6)c5)c4cc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 2/20 0.46
TSHR P16473 1/20 0.46
CYP2C19 P33261 1/20 0.46
FEN1 P39748 1/20 0.41
PDE4A P27815 6/20 0.38
PDE4B Q07343 5/20 0.38
PDE4C Q08493 5/20 0.38
PDE4D Q08499 5/20 0.38
LDHA P00338 1/20 0.35
KMT2A Q03164 2/20 0.35
IL1R1 P14778 1/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
GRM5 P41594 1/20 0.34

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
SCHEMBL21453975 0.96 L3MBTL1 (0.47) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL21407088 0.92 KDM4E (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL17523191 0.92 CYP2C19 (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL29431097 0.92 CYP2C19 (0.46) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL15855401 0.91 ALDH1A1 (0.45) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL17349373 0.91 ALDH1A1 (0.48) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL20747523 0.91 CYP2C19 (0.47) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL17348713 0.90 ALDH1A1 (0.45) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL18958676 0.90 ALDH1A1 (0.45) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL21481357 0.90 ALDH1A1 (0.44) L3MBTL1KDM4EATMALDH1A1TSHR

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-11469381-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-10-11 US disclosed
US-20190312209-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-10-10 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-11469381-B2 Condensed cyclic compound and organic light-emitting device including the same ARL1, CCNL2, CRY1 L3MBTL1 344/4885KDM4E 3923/4885ATM 723/4885
US-20190312209-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME ARL1, CCNL2, CRY1 L3MBTL1 344/4885KDM4E 3923/4885ATM 723/4885

“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.