SCHEMBL22237598

SCHEMBL22237598

C=Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5cc(Nc6ccc(F)cc6)ccc5c4)ccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 2/20 0.36
▸ PIK3CA P42336 2/20 0.36
▸ MTOR P42345 2/20 0.36
▸ NR3C1 P04150 1/20 0.34
▸ FAAH O00519 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ACP1 P24666 1/20 0.32
▸ MAPKAPK2 P49137 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ GRIA1 P42261 1/20 0.31
▸ CACNG8 Q8WXS5 1/20 0.31
▸ CACNG2 Q9Y698 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ CNR2 P34972 3/20 0.31
▸ KDM1A O60341 1/20 0.31

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
SCHEMBL22237739 0.85 KDM4E (0.41) ALDH1A1MAPKAPK2KDM4EATML3MBTL1
SCHEMBL22237590 0.84 ALDH1A1 (0.44) ALDH1A1HPGDCYP3A4HSD17B10KDM4E
SCHEMBL22237710 0.83 MAPKAPK2 (0.33) MAPKAPK2
SCHEMBL23865676 0.81 PIK3CG (0.36) ALDH1A1HPGDCYP3A4HSD17B10MAPKAPK2
SCHEMBL14029464 0.81 KDM4E (0.44) PIK3CAMTORNR3C1ALDH1A1HPGD
SCHEMBL12928087 0.81 ALDH1A1 (0.44) PIK3CDPIK3CAMTORALDH1A1HPGD
SCHEMBL14902280 0.81 NR3C1 (0.44) PIK3CAMTORNR3C1ALDH1A1HPGD
SCHEMBL14029515 0.81 ALDH1A1 (0.47) FAAHALDH1A1HPGDCYP3A4HSD17B10
SCHEMBL21020974 0.81 KDM4E (0.44) ALDH1A1HSD17B10KDM4EATML3MBTL1
SCHEMBL14029451 0.80 KDM4E (0.49) NR3C1ALDH1A1HPGDACP1MAPKAPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11572346-B2 Compound, coating composition comprising same, and organic light-emitting device LG CHEM, LTD. 2023-02-07 — — US disclosed
US-20210147358-A1 Compound, Coating Composition Comprising Same, and Organic Light-Emitting Device LG CHEM, LTD. (KR) 2021-05-20 — — US disclosed
EP-3683208-A1 COMPOUND, COATING COMPOSITION COMPRISING SAME, AND ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2020-07-22 — — 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 (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-20210147358-A1 Compound, Coating Composition Comprising Same, and Organic Light-Emitting Device OR10J3, CRY1, CRY2 PIK3CD 4205/4885PIK3CA 3984/4885MTOR 2922/4885
US-11572346-B2 Compound, coating composition comprising same, and organic light-emitting device OR10J3, CRY1, CRY2 PIK3CD 4205/4885PIK3CA 3984/4885MTOR 2922/4885

“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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