SCHEMBL26021707

SCHEMBL26021707

c1ccc(-c2cc3ccccc3c3ccccc23)c(-c2ccc(Nc3ccc(-c4cccc5ccccc45)cc3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 3/20 0.47
HPGD P15428 2/20 0.47
TSHR P16473 2/20 0.47
HIF1A Q16665 2/20 0.47
MAPK1 P28482 1/20 0.47
CASP1 P29466 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA9 Q16790 3/20 0.43
PPARG P37231 5/20 0.40
PPARA Q07869 5/20 0.40
MCL1 Q07820 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
ENPP3 O14638 1/20 0.40
ENPP1 P22413 1/20 0.40

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
SCHEMBL25569229 0.95 HDAC8 (0.46) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL23821157 0.90 ALDH1A1 (0.47) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL29637423 0.89 ALDH1A1 (0.43) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL23277121 0.89 ALDH1A1 (0.43) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL26021799 0.89 ALDH1A1 (0.44) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL25088292 0.88 HPRT1 (0.50) ALDH1A1HSD17B10HPGDTSHRHDAC8
SCHEMBL24947193 0.88 CA12 (0.42) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL31146352 0.88 CA12 (0.42) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL31146385 0.88 CA12 (0.42) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL10136271 0.88 HDAC8 (0.54) ALDH1A1HSD17B10HPGDTSHRHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242498-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-08-03 US disclosed
US-20230242498-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-08-03 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 (1 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-20230242498-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CRY2, NR1D1 ALDH1A1 90/4885HSD17B10 991/4885HPGD 2944/4885

“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.