SCHEMBL20066618

SCHEMBL20066618

c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(C2(c4ccccc4)c4ccccc4-c4ccc(N(c5ccccc5)c5ccc6ccccc6c5)cc42)c2ccccc2-3)c2ccc3ccccc3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.30

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
SCHEMBL20066573 0.97 PDK2 (0.35) PDK2SLC6A2SLC6A4SLC6A3HSP90AA1
SCHEMBL20066552 0.91 PDK2 (0.41) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL20066632 0.90 PDK2 (0.34) PDK2
SCHEMBL20066620 0.88 PDK2 (0.34) PDK2ALDH1A1TDP1
SCHEMBL20066890 0.87 ALDH1A1 (0.41) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL20066557 0.86 ALDH1A1 (0.35) PDK2ALDH1A1CYP1A2CYP2D6MAPT
SCHEMBL24622288 0.86 KDM4E (0.38) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL23936077 0.85 SLC6A2 (0.32) PDK2SLC6A2SLC6A4SLC6A3HSP90AA1
SCHEMBL20066563 0.84 PDK2 (0.40) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL23963542 0.84 PDK2 (0.39) PDK2KDM4EALDH1A1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10907093-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2021-02-02 — — US disclosed
US-20180105741-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-04-19 — — US disclosed
US-20180105741-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-04-19 — — 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-20180105741-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME C1S, SCO2, CCND2 PDK2 1507/4885KDM4E 3947/4885ALDH1A1 1274/4885
US-10907093-B2 Condensed cyclic compound and organic light-emitting device including the same C1S, SCO2, CCND2 PDK2 1507/4885KDM4E 3947/4885ALDH1A1 1274/4885

“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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