SCHEMBL23347393

SCHEMBL23347393

c1ccc(-c2cccc3c2oc2c(-c4cc5c6cc7c(cc6c(-c6cccc8c6oc6c(-c9ccccc9)cccc68)cc5c5cc6c(cc45)-c4cccc5cccc-6c45)-c4cccc5cccc-7c45)cccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.44
▸ TSHR P16473 4/20 0.44
▸ HSD17B10 Q99714 4/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ HIF1A Q16665 3/20 0.44
▸ HPGD P15428 3/20 0.44
▸ TP53 P04637 2/20 0.44
▸ CASP1 P29466 2/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ ALOX5 P09917 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ PRKDC P78527 6/20 0.39
▸ PIK3CD O00329 3/20 0.38
▸ PIK3CA P42336 3/20 0.38
▸ PIK3CB P42338 3/20 0.38
▸ PIK3CG P48736 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ BRD4 O60885 2/20 0.38
▸ BRD2 P25440 2/20 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
SCHEMBL23347320 0.85 ALDH1A1 (0.44) ALDH1A1TSHRHSD17B10MAPK1HIF1A
SCHEMBL23347112 0.84 ALOX5 (0.52) ALDH1A1TSHRHSD17B10MAPK1HIF1A
SCHEMBL23081257 0.82 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10MAPK1HIF1A
SCHEMBL19202972 0.81 ALDH1A1 (0.45) ALDH1A1TSHRHSD17B10MAPK1HIF1A
SCHEMBL14476532 0.79 PRKDC (0.38) ALDH1A1TSHRHSD17B10HIF1AHPGD
SCHEMBL430105 0.79 PRKDC (0.46) ALDH1A1TSHRHSD17B10MAPK1HIF1A
SCHEMBL11713826 0.79 PRKDC (0.47) ALDH1A1TSHRHSD17B10MAPK1HIF1A
SCHEMBL19202816 0.78 ALDH1A1 (0.42) ALDH1A1TSHRHSD17B10MAPK1HIF1A
SCHEMBL22793752 0.78 TSHR (0.40) ALDH1A1TSHRHSD17B10MAPK1HIF1A
SCHEMBL19202737 0.77 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10MAPK1HIF1A

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-11844268-B2 Organic compound and organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2023-12-12 — — US disclosed
US-11844268-B2 Organic compound and organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2023-12-12 — — US disclosed
US-20210143335-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2021-05-13 — — 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-11844268-B2 Organic compound and organic light-emitting element OR51E2, OR10J3, NR2E3 ALDH1A1 151/4885TSHR 2943/4885HSD17B10 560/4885
US-20210143335-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT OR51E2, OR10J3, NR2E3 ALDH1A1 151/4885TSHR 2943/4885HSD17B10 560/4885

“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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