SCHEMBL29458487

SCHEMBL29458487

c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3ccccc34)c3ccccc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.52
▸ MAPT P10636 4/20 0.50
▸ HPGD P15428 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ MMP12 P39900 1/20 0.44
▸ MMP13 P45452 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ GABRP O00591 1/20 0.43
▸ GABRD O14764 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ TNKS O95271 1/20 0.43
▸ TP53 P04637 1/20 0.43

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
SCHEMBL18904981 1.00 AHR (0.52) AHRMAPTHPGDMEN1KMT2A
SCHEMBL22854823 0.98 AHR (0.50) AHRMAPTHPGDMEN1KMT2A
SCHEMBL20650038 0.98 AHR (0.50) AHRMAPTHPGDMEN1KMT2A
SCHEMBL17944545 0.96 AHR (0.49) AHRMAPTHPGDMEN1KMT2A
SCHEMBL17999986 0.96 AHR (0.55) AHRMAPTHPGDMEN1KMT2A
SCHEMBL23426640 0.95 MAPT (0.47) AHRMAPTHPGDMEN1KMT2A
SCHEMBL23426631 0.95 MAPT (0.47) AHRMAPTHPGDMEN1KMT2A
SCHEMBL21687000 0.95 AHR (0.47) AHRMAPTHPGDMEN1KMT2A
SCHEMBL23426722 0.95 MAPT (0.47) AHRMAPTHPGDMEN1KMT2A
SCHEMBL23426723 0.95 MAPT (0.47) AHRMAPTHPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250051250-A1 DIAMANTANE COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE TOSOH CORPORATION (JP) 2025-02-13 — — US disclosed
CN-113166098-B Triazine compound, material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2024-12-13 — — CN disclosed
CN-118434704-A Bimantane compound, material for organic electroluminescent device, and organic electroluminescent device 东曹株式会社 2024-08-02 — — CN disclosed
CN-116348454-A Triazine compound, material for organic electroluminescent element, electron-transporting material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2023-06-27 — — CN disclosed
WO-2022075219-A1 TRIAZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2022-04-14 — — 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-20250051250-A1 DIAMANTANE COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE AOC1, ODC1, DDT AHR 1115/4885MAPT 1001/4885HPGD 2714/4885

“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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