SCHEMBL21472969

SCHEMBL21472969

c1ccc2c(c1)c1ccccc1c1cc(-c3cccc4c5ccc6c7ccccc7c7cccc8c7c6c5n8c34)ccc21

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALOX5 P09917 1/20 0.30
DUSP3 P51452 1/20 0.30

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
SCHEMBL21472971 0.96
SCHEMBL21472974 0.89 GSTP1 (0.38) ALDH1A1HPGDTSHRMAPK1CASP1
SCHEMBL21472988 0.88 PRKDC (0.33) HPGDHSD17B10
SCHEMBL21461880 0.88 MAPK14 (0.34) HSD17B10DUSP3
SCHEMBL21472987 0.88 CDK4 (0.35) ALDH1A1HPGDHSD17B10DUSP3
SCHEMBL21472958 0.86 HSP90AA1 (0.33) ALDH1A1HPGD
SCHEMBL21473048 0.86 KDM4E (0.43) L3MBTL1DUSP3
SCHEMBL21472962 0.84 POLB (0.31) ALDH1A1HPGD
SCHEMBL21473028 0.83 TSPO (0.32) ALDH1A1HPGD
SCHEMBL21473101 0.82 MEN1 (0.34) ALDH1A1HPGDTSHRMAPK1HSD17B10

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-20190315759-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2019-10-17 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-20190315759-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES OSBP, OSBP2, OSBPL3 ALDH1A1 1398/4885HPGD 1208/4885TSHR 4716/4885

“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.