SCHEMBL22818311

SCHEMBL22818311

Clc1cccc2oc3c4ccccc4c(-c4ccccc4)cc3c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 7/20 0.47
▸ CYP2A6 P11509 1/20 0.40
▸ ALOX5 P09917 2/20 0.39
▸ CDC14B O60729 1/20 0.37
▸ CDC14A Q9UNH5 1/20 0.37
▸ TTR P02766 4/20 0.37
▸ CYP1A1 P04798 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP1B1 Q16678 1/20 0.37
▸ CTRC Q99895 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.36
▸ GABRP O00591 1/20 0.36
▸ GABRD O14764 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRB1 P18505 1/20 0.36
▸ GABRG2 P18507 1/20 0.36
▸ GABRB3 P28472 1/20 0.36
▸ GABRA5 P31644 1/20 0.36
▸ GABRA3 P34903 1/20 0.36
▸ GABRA2 P47869 1/20 0.36

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
SCHEMBL31597560 1.00 AHR (0.47) AHRCYP2A6ALOX5CDC14BCDC14A
SCHEMBL24672286 0.97 AHR (0.45) AHRCYP2A6ALOX5CDC14BCDC14A
SCHEMBL24672213 0.88 AHR (0.42) AHRCYP2A6ALOX5CDC14BCDC14A
SCHEMBL31393393 0.88 AHR (0.47) AHRCYP2A6ALOX5CDC14BCDC14A
SCHEMBL13935844 0.87 AHR (0.42) AHRCYP2A6ALOX5CDC14BCDC14A
SCHEMBL24255989 0.86 AHR (0.41) AHRTTR
SCHEMBL13935802 0.85 ALOX5 (0.42) ALOX5CDC14BCDC14ACYP1A1CYP1A2
SCHEMBL31432558 0.84 AHR (0.42) AHRALOX5TTRCYP1A1CYP1A2
SCHEMBL20962219 0.84 AHR (0.50) AHRCYP2A6ALOX5CDC14BCDC14A
SCHEMBL31120342 0.84 AHR (0.50) AHRCYP2A6ALOX5CDC14BCDC14A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11812623-B2 Hetero-cyclic compound and organic light emitting device using the same LT MATERIALS CO., LTD. (KR) 2023-11-07 — — US disclosed
US-11812623-B2 Hetero-cyclic compound and organic light emitting device using the same LT MATERIALS CO., LTD. (KR) 2023-11-07 — — US disclosed
WO-2023171951-A1 ORGANIC LIGHT-EMITTING DEVICE, METHOD FOR MANUFACTURING SAME, AND COMPOSITION FOR ORGANIC MATERIAL LAYER 엘티소재주식회사 2023-09-14 — — WO disclosed
US-20230036794-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2023-02-02 — — US disclosed
EP-4015515-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT Materials Co., Ltd. (KR) 2022-06-22 — — EP disclosed
WO-2021034039-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 엘티소재주식회사 2021-02-25 — — WO disclosed
EP-3757095-A2 HETERO-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME LT Materials Co., Ltd. (KR) 2020-12-30 — — EP disclosed
US-20200403157-A1 HETERO-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME LT MATERIALS CO., LTD. (KR) 2020-12-24 — — 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-11812623-B2 Hetero-cyclic compound and organic light emitting device using the same CRY1, CRY2, PER2 AHR 461/4885CYP2A6 422/4885ALOX5 1385/4885
US-20230036794-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE OCIAD1, OCIAD2, OXER1 AHR 2001/4885CYP2A6 1216/4885ALOX5 320/4885
US-20200403157-A1 HETERO-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CRY1, CRY2, PER2 AHR 461/4885CYP2A6 422/4885ALOX5 1385/4885

“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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