SCHEMBL20733798

SCHEMBL20733798

c1ccc(-c2nc(-c3ccc4c5ccccc5c5ccccc5c4c3)nc(-c3nnc4c5cccnc5c5ncccc5c4n3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TOP1 P11387 2/20 0.35
▸ PDE5A O76074 2/20 0.34
▸ PIK3CA P42336 2/20 0.34
▸ CCR1 P32246 2/20 0.34
▸ CCR8 P51685 2/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ DHFR P00374 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RAB9A P51151 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
SCHEMBL20733802 0.89 L3MBTL1 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20733789 0.85 ALDH1A1 (0.41) ALDH1A1MAPTTOP1CCR1CCR8
SCHEMBL20733790 0.85 ALDH1A1 (0.41) ALDH1A1MAPTTOP1CCR1CCR8
SCHEMBL20733712 0.83 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL12761842 0.83 NPC1 (0.45) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL20733736 0.83 ALDH1A1 (0.37) ALDH1A1MAPTTOP1CCR1CCR8
SCHEMBL17720910 0.81 ABCG2 (0.40) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL20733851 0.80 L3MBTL1 (0.41) ABCG2ALDH1A1MAPTTOP1CCR1
SCHEMBL14884138 0.80 ALDH1A1 (0.42) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL17995349 0.80 MEN1 (0.50) ABCG2MEN1KMT2AALDH1A1MAPT

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-20230057590-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2023-02-23 — — US disclosed
US-20190051842-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2019-02-14 — — 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-20230057590-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OXER1 ABCG2 3898/4885MEN1 4005/4885KMT2A 2008/4885
US-20190051842-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OXER1 ABCG2 3898/4885MEN1 4005/4885KMT2A 2008/4885

“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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