SCHEMBL20404862

SCHEMBL20404862

N#Cc1ccc(-c2ccc(-c3ccccc3-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 14/20 0.51
▸ ABCB1 P08183 8/20 0.51
▸ ABCC1 P33527 3/20 0.46
▸ ALDH1A3 P47895 1/20 0.46
▸ GABRA1 P14867 1/20 0.45
▸ GABRG2 P18507 1/20 0.45
▸ GABRB3 P28472 1/20 0.45
▸ GABRA5 P31644 1/20 0.45
▸ GABRA3 P34903 1/20 0.45
▸ CYP11B2 P19099 1/20 0.45
▸ MYC P01106 1/20 0.43
▸ TSHR P16473 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
SCHEMBL31643041 0.93 ABCG2 (0.49) ABCG2ABCB1ABCC1ALDH1A3GABRA1
SCHEMBL27453359 0.93 ABCG2 (0.49) ABCG2ABCB1ABCC1ALDH1A3GABRA1
SCHEMBL25875705 0.93 ABCG2 (0.46) ABCG2ABCB1ABCC1ALDH1A3GABRA1
SCHEMBL27368624 0.93 ABCG2 (0.49) ABCG2ABCB1ABCC1ALDH1A3GABRA1
SCHEMBL26592150 0.93 ABCG2 (0.46) ABCG2ABCB1ABCC1ALDH1A3GABRA1
SCHEMBL27453612 0.93 ABCG2 (0.49) ABCG2ABCB1ABCC1ALDH1A3GABRA1
SCHEMBL31642779 0.92 ABCG2 (0.51) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31643499 0.91 ABCG2 (0.48) ABCG2ABCB1ABCC1ALDH1A3GABRA1
SCHEMBL25875320 0.91 ABCG2 (0.47) ABCG2ABCB1ABCC1ALDH1A3GABRA1
SCHEMBL27368625 0.91 ABCG2 (0.50) ABCG2ABCB1ABCC1GABRA1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11737357-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. 2023-08-22 — — US disclosed
US-11737357-B2 Compound and organic light-emitting device comprising same LG CHEM, LTD. 2023-08-22 — — US disclosed
US-20230255104-A1 Compound And Organic Light-Emitting Device Comprising Same LG CHEM, LTD. (KR) 2023-08-10 — — US disclosed
US-20230255104-A1 Compound And Organic Light-Emitting Device Comprising Same LG CHEM, LTD. (KR) 2023-08-10 — — US disclosed
EP-3351537-B1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2023-01-18 — — EP disclosed
EP-3351536-B1 ORGANIC LIGHT-EMITTING DEVICE LG CHEMICAL LTD (KR) 2021-07-21 — — EP disclosed
US-10367149-B2 Organic light-emitting device LG CHEM, LTD. (KR) 2019-07-30 — — US disclosed
US-20190055222-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2019-02-21 — — US disclosed
EP-3351536-A1 ORGANIC LIGHT-EMITTING DEVICE LG Chem, Ltd. (KR) 2018-07-25 — — EP disclosed
EP-3351537-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG Chem, Ltd. (KR) 2018-07-25 — — EP 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 (4 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-11737357-B2 Compound and organic light-emitting device comprising same CRY1, CYP1B1, CYP1A1 ABCG2 939/4885ABCB1 206/4885ABCC1 449/4885
US-20230255104-A1 Compound And Organic Light-Emitting Device Comprising Same ARL1, AR, ALG3 ABCG2 2609/4885ABCB1 2021/4885ABCC1 1796/4885
US-10367149-B2 Organic light-emitting device CRY1, PPOX, CRY2 ABCG2 3141/4885ABCB1 2481/4885ABCC1 3713/4885
US-20190055222-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, CYP1B1, CYP1A1 ABCG2 939/4885ABCB1 206/4885ABCC1 449/4885

“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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