SCHEMBL19010448

SCHEMBL19010448

Brc1ccc2c(c1)sc1cc(-c3ccccc3)ccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ LIMK1 P53667 2/20 0.44
▸ PIK3CA P42336 1/20 0.41
▸ PI4KA P42356 1/20 0.41
▸ PI4KB Q9UBF8 1/20 0.41
▸ GRIN2D O15399 1/20 0.40
▸ GRIN2A Q12879 1/20 0.40
▸ GRIN2B Q13224 1/20 0.40
▸ GRIN2C Q14957 1/20 0.40
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ F9 P00740 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ DCLK1 O15075 1/20 0.38

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
SCHEMBL28796957 0.91 ALDH1A1 (0.45) ALDH1A1MAPK1LIMK1PIK3CAPI4KA
SCHEMBL24809292 0.91 ALDH1A1 (0.45) ALDH1A1MAPK1LIMK1PIK3CAPI4KA
SCHEMBL22914399 0.91 NPC1 (0.42) ALDH1A1MAPK1LIMK1PIK3CAPI4KA
SCHEMBL17037088 0.89 LIMK1 (0.49) ALDH1A1MAPK1LIMK1PIK3CAPI4KA
SCHEMBL23505121 0.89 ALDH1A1 (0.42) ALDH1A1MAPK1LIMK1PIK3CAPI4KA
SCHEMBL10110898 0.88 LIMK1 (0.51) ALDH1A1MAPK1LIMK1PIK3CAPI4KA
SCHEMBL12562737 0.88 LIMK1 (0.51) ALDH1A1MAPK1LIMK1PIK3CAPI4KA
SCHEMBL21066303 0.88 ALDH1A1 (0.41) ALDH1A1MAPK1LIMK1RAB9ASMN1; SMN2
SCHEMBL29793995 0.88 ALDH1A1 (0.41) ALDH1A1MAPK1LIMK1RAB9ASMN1; SMN2
SCHEMBL28796980 0.88 ALDH1A1 (0.50) ALDH1A1MAPK1LIMK1PIK3CAPI4KA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11793068-B2 Amine compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-17 — — US disclosed
US-11793068-B2 Amine compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-17 — — US disclosed
US-20230189638-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE AND ELECTRONIC APPARATUS THEREOF SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-15 — — US disclosed
US-20230189638-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE AND ELECTRONIC APPARATUS THEREOF SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-15 — — US disclosed
WO-2022199449-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE COMPRISING SAME, AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2022-09-29 — — WO disclosed
US-20210359230-A1 AMINE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-11-18 — — US disclosed
US-11121329-B2 Amine compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2021-09-14 — — US disclosed
US-20190165285-A1 AMINE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-05-30 — — US disclosed
WO-2017102064-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-06-22 — — WO 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 (5 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-20210359230-A1 AMINE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME AOC2, H1-2, CHRM1 ALDH1A1 957/4885MAPK1 1377/4885LIMK1 579/4885
US-11121329-B2 Amine compound and organic electroluminescence device including the same AOC2, H1-2, CHRM1 ALDH1A1 957/4885MAPK1 1377/4885LIMK1 579/4885
US-20230189638-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE AND ELECTRONIC APPARATUS THEREOF AOX1, PIEZO1, CYP2E1 ALDH1A1 151/4885MAPK1 642/4885LIMK1 474/4885
US-20190165285-A1 AMINE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME ODC1, PNMT, SAT1 ALDH1A1 113/4885MAPK1 1068/4885LIMK1 1352/4885
US-11793068-B2 Amine compound and organic electroluminescence device including the same AOC2, H1-2, CHRM1 ALDH1A1 957/4885MAPK1 1377/4885LIMK1 579/4885

“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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