SCHEMBL26047995

SCHEMBL26047995

c1ccc2c(-c3ccc(-c4c5ccccc5c(-c5cc6ccccc6c6ccccc56)c5ccccc45)cc3)cccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.46
▸ HIF1A Q16665 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CA12 O43570 3/20 0.45
▸ CA1 P00915 3/20 0.45
▸ CA2 P00918 3/20 0.45
▸ CA9 Q16790 3/20 0.45
▸ HDAC8 Q9BY41 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ MCL1 Q07820 1/20 0.42
▸ ACMSD Q8TDX5 1/20 0.42
▸ ENPP3 O14638 1/20 0.42
▸ ENPP1 P22413 1/20 0.42
▸ SOS1 Q07889 1/20 0.41
▸ CYP1B1 Q16678 1/20 0.41

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
SCHEMBL30350883 0.88 ALDH1A1 (0.44) ALDH1A1HIF1AHSD17B10HPGDTSHR
SCHEMBL22978404 0.88 ALDH1A1 (0.44) ALDH1A1HIF1AHSD17B10HPGDTSHR
SCHEMBL19199345 0.88 HPRT1 (0.50) ALDH1A1HIF1AHSD17B10HPGDTSHR
SCHEMBL3925327 0.87 CA12 (0.51) CA12CA1CA2CA9HDAC8
SCHEMBL24446252 0.87 CA12 (0.55) CA12CA1CA2CA9HDAC8
SCHEMBL18880008 0.86 ALDH1A1 (0.45) ALDH1A1HIF1AHSD17B10HPGDTSHR
SCHEMBL1527423 0.85 ALOX5 (0.52) ALDH1A1HIF1AHSD17B10HPGDTSHR
SCHEMBL30100401 0.85 ALOX5 (0.52) ALDH1A1HIF1AHSD17B10HPGDTSHR
SCHEMBL19200465 0.84 ALDH1A1 (0.47) ALDH1A1HIF1AHSD17B10HPGDTSHR
SCHEMBL13298492 0.84 SOS1 (0.37) ALDH1A1HIF1AHSD17B10HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230276706-A1 NOVEL HETEROCYCLIC COMPOUND AND LIGHT-EMITTING DIODE INCLUDING SAME SFC CO., LTD. (KR) 2023-08-31 — — 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-20230276706-A1 NOVEL HETEROCYCLIC COMPOUND AND LIGHT-EMITTING DIODE INCLUDING SAME CYBA, CYP1B1, PPOX ALDH1A1 30/4885HIF1A 3270/4885HSD17B10 660/4885

“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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