SCHEMBL22505848

SCHEMBL22505848

Clc1ccc2c(c1)oc1ccc(N(c3ccccc3)c3ccc(-c4ccccc4)cc3)cc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 7/20 0.54
▸ CA1 P00915 3/20 0.42
▸ CA2 P00918 3/20 0.42
▸ ADORA3 P0DMS8 2/20 0.42
▸ TNKS O95271 1/20 0.42
▸ CASP3 P42574 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ CYP1A2 P05177 1/20 0.37
▸ TTR P02766 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ GABRP O00591 1/20 0.35
▸ GABRD O14764 1/20 0.35
▸ GABRA1 P14867 1/20 0.35
▸ GABRB1 P18505 1/20 0.35
▸ GABRG2 P18507 1/20 0.35
▸ GABRB3 P28472 1/20 0.35
▸ GABRA5 P31644 1/20 0.35

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
SCHEMBL22505958 0.99 AHR (0.55) AHRCA1CA2ADORA3TNKS
SCHEMBL22505849 0.95 AHR (0.51) AHRCA1CA2ADORA3TNKS
SCHEMBL22505837 0.94 AHR (0.60) AHRCA1CA2ADORA3TNKS
SCHEMBL22505847 0.94 AHR (0.50) AHRCA1CA2ADORA3TNKS
SCHEMBL22506179 0.93 AHR (0.53) AHRCA1CA2ADORA3TNKS
SCHEMBL22506061 0.93 AHR (0.55) AHRCA1CA2ADORA3TNKS
SCHEMBL22506492 0.92 AHR (0.46) AHRCA1CA2ADORA3TNKS
SCHEMBL22505841 0.91 AHR (0.48) AHRCA1CA2ADORA3TNKS
SCHEMBL23515752 0.90 MEN1 (0.38) AHRTNKSSMN1; SMN2CYP1A2KDM4E
SCHEMBL21966399 0.90 MEN1 (0.38) AHRTNKSSMN1; SMN2CYP1A2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210028370-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREFOR DUK SAN NEOLUX CO., LTD. (KR) 2021-01-28 — — US disclosed
US-20200321530-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2020-10-08 — — 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-20200321530-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF PIEZO1, LEF1, ELP1 AHR 3032/4885CA1 818/4885CA2 1384/4885
US-20210028370-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREFOR OR51E2, WEE1, SLC39A11 AHR 1629/4885CA1 1972/4885CA2 2465/4885

“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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