SCHEMBL17885394

SCHEMBL17885394

c1ccc2c(c1)[nH]c1ccc(-c3cccc4oc5ccccc5c34)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 1/20 0.44
▸ CASP3 P42574 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ GPR3 P46089 1/20 0.41
▸ ALOX5 P09917 1/20 0.40
▸ KIF11 P52732 5/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HCRTR1 O43613 1/20 0.39
▸ GABRP O00591 2/20 0.38
▸ GABRD O14764 2/20 0.38
▸ GABRA1 P14867 2/20 0.38
▸ GABRB1 P18505 2/20 0.38
▸ GABRG2 P18507 2/20 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
SCHEMBL17885202 0.92 CASP3 (0.43) CASP3SENP7SENP6ALOX5KDM4E
SCHEMBL23558095 0.91 AHR (0.44) AHRALDH1A1HSD17B10GPR3ALOX5
SCHEMBL26055933 0.91 CASP3 (0.43) AHRCASP3SENP7SENP6ALDH1A1
SCHEMBL25470985 0.90 AHR (0.49) AHRCASP3SENP7SENP6ALDH1A1
SCHEMBL17885210 0.90 CASP3 (0.45) AHRCASP3SENP7SENP6ALDH1A1
SCHEMBL26055957 0.90 CDK4 (0.41) AHRCASP3SENP7SENP6ALOX5
SCHEMBL31288261 0.87 AHR (0.46) AHRCASP3SENP7SENP6ALDH1A1
SCHEMBL457912 0.84 ALOX5 (0.59) AHRCASP3SENP7SENP6ALDH1A1
SCHEMBL30395989 0.84 ALOX5 (0.59) AHRCASP3SENP7SENP6ALDH1A1
SCHEMBL30487044 0.84 ALOX5 (0.59) AHRCASP3SENP7SENP6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117777175-A Organic boron fused ring compound and preparation method and application thereof 中国科学院长春应用化学研究所 2024-03-29 — — CN disclosed
US-20230276690-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2023-08-31 — — US disclosed
EP-3679023-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-11-02 — — EP disclosed
EP-3679024-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-11-02 — — EP disclosed
EP-3237409-B1 CARBAZOLES WITH TWO DIBENZOFURAN OR DIBENZOTHIOPHENE SUBSTITUENTS MERCK PATENT GMBH (DE) 2022-01-05 — — EP disclosed
US-20190044071-A1 CARBAZOLES WITH TWO DIBENZOFURAN OR DIBENZOTHIOPHENE SUBSTITUENTS MERCK PATENT GMBH (DE) 2019-02-07 — — US disclosed
WO-2016102040-A1 CARBAZOLES WITH TWO DIBENZOFURAN OR DIBENZOTHIOPHENE SUBSTITUENTS MERCK PATENT GMBH (DE) 2016-06-30 — — 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 (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-20230276690-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME L1CAM, TELO2, LIMS1 AHR 4023/4885CASP3 443/4885SENP7 3428/4885
US-20190044071-A1 CARBAZOLES WITH TWO DIBENZOFURAN OR DIBENZOTHIOPHENE SUBSTITUENTS BRD3, BRPF3, DDT AHR 115/4885CASP3 1113/4885SENP7 3524/4885

“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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