SCHEMBL22379957

SCHEMBL22379957

Brc1cccc(-c2cccc(CCCCCCc3ccccc3)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 3/20 0.47
▸ SIGMAR1 Q99720 3/20 0.47
▸ GABRG2 P18507 3/20 0.44
▸ GABRB3 P28472 3/20 0.44
▸ GABRA5 P31644 3/20 0.44
▸ GABRA3 P34903 3/20 0.44
▸ IGF1R P08069 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ GABRA1 P14867 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ MAOB P27338 1/20 0.42
▸ TP53 P04637 1/20 0.42

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
SCHEMBL30444743 0.89 TAAR1 (0.59) TAAR1SIGMAR1IGF1RALOX15MAOA
SCHEMBL16203114 0.89 TAAR1 (0.59) TAAR1SIGMAR1IGF1RALOX15MAOA
SCHEMBL28585404 0.89 TAAR1 (0.59) TAAR1SIGMAR1IGF1RALOX15MAOA
SCHEMBL13569139 0.87 TAAR1 (0.61) TAAR1SIGMAR1IGF1RALOX15MAOA
SCHEMBL29618101 0.87 SIGMAR1 (0.52) SIGMAR1IGF1RALOX15MAOAMAPT
SCHEMBL27390155 0.86 LPL (0.51) TAAR1
SCHEMBL5139428 0.83 TAAR1 (0.61) TAAR1SIGMAR1IGF1RALOX15MAOA
SCHEMBL19524669 0.82 TAAR1 (0.65) TAAR1SIGMAR1SMN1; SMN2MAOB
SCHEMBL22227406 0.80 HTR7 (0.42) SIGMAR1IGF1RALOX15
SCHEMBL23759726 0.80 TDP2 (0.41) SIGMAR1MAPTNPC1DAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116390928-A Organic electroluminescent element, organic EL display device, and organic EL illumination 三菱化学株式会社 2023-07-04 — — CN disclosed
WO-2022092046-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING 三菱ケミカル株式会社 2022-05-05 — — WO disclosed
WO-2021161974-A1 IRIDIUM COMPLEX COMPOUND, IRIDIUM COMPLEX COMPOUND-CONTAINING COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT AND PRODUCTION METHOD THEREFOR, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL LIGHTING DEVICE 三菱ケミカル株式会社 2021-08-19 — — WO disclosed
US-20210257564-A1 IRIDIUM COMPLEX COMPOUND, COMPOSITION CONTAINING THE COMPOUND AND SOLVENT, ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THE COMPOUND, DISPLAY DEVICE, AND ILLUMINATION DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2021-08-19 — — US disclosed
US-11038126-B2 Iridium complex compound, composition containing the compound and solvent, organic electroluminescent element containing the compound, display device, and illumination device MITSUBISHI CHEMICAL CORPORATION (JP) 2021-06-15 — — US disclosed
US-20200274078-A1 IRIDIUM COMPLEX COMPOUND, COMPOSITION CONTAINING THE COMPOUND AND SOLVENT, ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THE COMPOUND, DISPLAY DEVICE, AND ILLUMINATION DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2020-08-27 — — 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 (3 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-20210257564-A1 IRIDIUM COMPLEX COMPOUND, COMPOSITION CONTAINING THE COMPOUND AND SOLVENT, ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THE COMPOUND, DISPLAY DEVICE, AND ILLUMINATION DEVICE RB1, ARL1, CDKL1 TAAR1 2276/4885SIGMAR1 4278/4885GABRG2 4470/4885
US-11038126-B2 Iridium complex compound, composition containing the compound and solvent, organic electroluminescent element containing the compound, display device, and illumination device ACVRL1, CCNL2, CXCR1 TAAR1 829/4885SIGMAR1 956/4885GABRG2 3811/4885
US-20200274078-A1 IRIDIUM COMPLEX COMPOUND, COMPOSITION CONTAINING THE COMPOUND AND SOLVENT, ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THE COMPOUND, DISPLAY DEVICE, AND ILLUMINATION DEVICE ACVRL1, CCNL2, CXCR1 TAAR1 829/4885SIGMAR1 956/4885GABRG2 3811/4885

“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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