SCHEMBL29993340

SCHEMBL29993340

Clc1cc(-c2ccccc2)c2oc3ccccc3c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 5/20 0.51
▸ ALOX5 P09917 2/20 0.44
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ ADORA3 P0DMS8 4/20 0.42
▸ TNKS O95271 3/20 0.42
▸ GABRP O00591 2/20 0.41
▸ GABRD O14764 2/20 0.41
▸ GABRA1 P14867 2/20 0.41
▸ GABRB1 P18505 2/20 0.41
▸ GABRG2 P18507 2/20 0.41
▸ GABRB3 P28472 2/20 0.41
▸ GABRA5 P31644 2/20 0.41
▸ GABRA3 P34903 2/20 0.41
▸ GABRA2 P47869 2/20 0.41
▸ GABRB2 P47870 2/20 0.41
▸ GABRA4 P48169 2/20 0.41
▸ GABRE P78334 2/20 0.41
▸ GABRA6 Q16445 2/20 0.41
▸ GABRG1 Q8N1C3 2/20 0.41

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
SCHEMBL22884595 1.00 AHR (0.51) AHRALOX5CA1CA2ADORA3
SCHEMBL25762962 0.97 AHR (0.49) AHRALOX5CA1CA2ADORA3
SCHEMBL24171352 0.93 ALOX5 (0.46) AHRALOX5CA1CA2ADORA3
SCHEMBL25762968 0.92 AHR (0.47) AHRALOX5CA1CA2ADORA3
SCHEMBL25762948 0.91 ALOX5 (0.47) AHRALOX5CA1CA2ADORA3
SCHEMBL22136027 0.90 AHR (0.43) AHRALOX5NPC1HPGDRAB9A
SCHEMBL29312766 0.89 AHR (0.42) AHRALOX5CA1CA2ADORA3
SCHEMBL29183583 0.88 ALOX5 (0.51) AHRALOX5CA1CA2ADORA3
SCHEMBL25635987 0.88 TTR (0.53) CA1CA2ADORA3TNKSGABRP
SCHEMBL29312726 0.87 AHR (0.43) AHRALOX5CA1CA2ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220255020-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-08-11 — — 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 (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-20220255020-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, CHRM1 AHR 220/4885ALOX5 586/4885CA1 3993/4885

“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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