SCHEMBL23421832

SCHEMBL23421832

CC(C)(C)c1ccc(Nc2ccc3oc4cc(C(C)(C)C)ccc4c3c2)c(-c2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ABCG2 Q9UNQ0 2/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ KCNK18 Q7Z418 1/20 0.34
▸ HPGD P15428 2/20 0.33
▸ PON1 P27169 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL31069466 0.96 ALDH1A1 (0.38) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL31069296 0.95 ALDH1A1 (0.40) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL29640000 0.94 ALDH1A1 (0.38) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL23439342 0.94 ALDH1A1 (0.38) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL31069384 0.94 ALDH1A1 (0.38) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL23439697 0.94 ALDH1A1 (0.38) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL23439032 0.92 SMN1; SMN2 (0.41) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL31069400 0.92 SMN1; SMN2 (0.41) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL30363377 0.91 ALDH1A1 (0.36) ALDH1A1MAPTABCG2MEN1KMT2A
SCHEMBL26599597 0.91 ALDH1A1 (0.36) ALDH1A1MAPTABCG2MEN1KMT2A

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
CN-113924307-B Polycyclic compound and organic light-emitting element including the same 株式会社LG化学 2024-08-20 — — CN disclosed
US-20230106317-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2023-04-06 — — US disclosed
WO-2021107711-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-06-03 — — WO 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 (1 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-20230106317-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CCNL2, NR1H3, NR1H2 ALDH1A1 2893/4885MAPT 3836/4885ABCG2 4338/4885

“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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