SCHEMBL24738583

SCHEMBL24738583

Fc1cc(Br)c2oc3cc(Cl)ccc3c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 9/20 0.53
▸ MCL1 Q07820 2/20 0.36
▸ TTR P02766 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ CDC25A P30304 1/20 0.35
▸ CDC25C P30307 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ GPR55 Q9Y2T6 1/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ DAO P14920 1/20 0.33
▸ GABRP O00591 1/20 0.33
▸ GABRD O14764 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA5 P31644 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
SCHEMBL28559809 0.83 AHR (0.56) AHRMCL1TTRCDC25ACDC25C
SCHEMBL23094108 0.83 AHR (0.56) AHRMCL1TTRESR2CDC25A
SCHEMBL22253153 0.79 AHR (0.50) AHRMCL1TTRCDC25ACDC25C
SCHEMBL19041865 0.78 AHR (0.46) AHRALDH1A1LMNAKMT2AGABRP
SCHEMBL24738892 0.77 AHR (0.53) AHRMCL1TTRCDC25ACDC25C
SCHEMBL24738581 0.77 AHR (0.53) AHRMCL1TTRCDC25ACDC25C
SCHEMBL21178184 0.77 AHR (0.58) AHRMCL1TTRCDC25ACDC25C
SCHEMBL24738749 0.76 AHR (0.49) AHRMCL1CDC25ACDC25CALDH1A1
SCHEMBL22078333 0.74 AHR (0.66) AHRMCL1TTRCDC25ACDC25C
SCHEMBL23033824 0.74 AHR (0.59) AHRMCL1TTRCA1CA2

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
US-20230247904-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-08-03 — — US disclosed
US-20230247904-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-08-03 — — US disclosed
US-20220396568-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT-EMITTING DEVICE, AND METHOD FOR MANUFACTURING ORGANIC LIGHT-EMITTING DEVICE LT MATERIALS CO., LTD. (KR) 2022-12-15 — — 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-20220396568-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT-EMITTING DEVICE, AND METHOD FOR MANUFACTURING ORGANIC LIGHT-EMITTING DEVICE CYP1A1, CYP1B1, CRY1 AHR 31/4885MCL1 1563/4885TTR 3381/4885
US-20230247904-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME NR2E3, CRY2, DRD1 AHR 13/4885MCL1 2276/4885TTR 3884/4885

“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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