SCHEMBL20967349

SCHEMBL20967349

O=P(c1ccccc1)(c1ccccc1)c1cccc(-c2cccc(-c3nc(-c4ccc(F)cc4)nc(-c4ccc(F)cc4)n3)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 1/20 0.43
▸ ADCY8 P40145 2/20 0.43
▸ ADCY1 Q08828 2/20 0.43
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ KAT6A Q92794 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ PPARG P37231 1/20 0.39
▸ NCOA2 Q15596 1/20 0.39
▸ NCOA1 Q15788 1/20 0.39
▸ NCOA3 Q9Y6Q9 1/20 0.39
▸ DPP4 P27487 1/20 0.39
▸ NR3C1 P04150 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 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
SCHEMBL20967346 0.97 TOP1 (0.44) TOP1ADCY8ADCY1ABCG2KAT6A
SCHEMBL20967426 0.97 TOP1 (0.44) TOP1ADCY8ADCY1ABCG2KAT6A
SCHEMBL20967450 0.97 TOP1 (0.44) TOP1ADCY8ADCY1ABCG2KAT6A
SCHEMBL20967317 0.97 TOP1 (0.44) TOP1ADCY8ADCY1ABCG2KAT6A
SCHEMBL20967400 0.97 TOP1 (0.44) TOP1ADCY8ADCY1ABCG2KAT6A
SCHEMBL20967448 0.97 TOP1 (0.44) TOP1ADCY8ADCY1ABCG2KAT6A
SCHEMBL20967351 0.96 TOP1 (0.44) TOP1ADCY8ADCY1ABCG2KAT6A
SCHEMBL20967468 0.94 TOP1 (0.44) TOP1ADCY8ADCY1ABCG2KAT6A
SCHEMBL20967320 0.93 TOP1 (0.42) TOP1ADCY8ADCY1ABCG2KDM4E
SCHEMBL20967446 0.91 TAAR1 (0.46) ABCG2DPP4CYP3A4

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-11251376-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2022-02-15 — — US disclosed
US-20190131535-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-05-02 — — 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-11251376-B2 Heterocyclic compound and organic light-emitting device including the same LAGE3, DDT, AOC2 TOP1 2383/4885ADCY8 1818/4885ADCY1 2769/4885
US-20190131535-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME LAGE3, DDT, AOC2 TOP1 2383/4885ADCY8 1818/4885ADCY1 2769/4885

“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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