SCHEMBL29307845

SCHEMBL29307845

COc1cc2c3cc(OC)c(OC)cc3c3c(cc(OC)c4oc(-c5cccc6ccccc56)nc43)c2cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.42
▸ KDM4E B2RXH2 9/20 0.42
▸ HPGD P15428 8/20 0.42
▸ MAPT P10636 7/20 0.42
▸ MEN1 O00255 5/20 0.42
▸ KMT2A Q03164 5/20 0.42
▸ GLA P06280 4/20 0.42
▸ CTSG P08311 3/20 0.41
▸ KLK7 P49862 3/20 0.41
▸ KLK14 Q9P0G3 3/20 0.41
▸ KLK5 Q9Y337 3/20 0.41
▸ CTRC Q99895 1/20 0.40
▸ HSD17B10 Q99714 6/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ C1R P00736 1/20 0.40
▸ AHR P35869 1/20 0.39
▸ ALOX15 P16050 3/20 0.39
▸ GAA P10253 4/20 0.39
▸ CASP1 P29466 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
SCHEMBL29307866 0.85 KLK7 (0.58) MEN1KMT2ACTSGKLK7KLK14
SCHEMBL29307903 0.85 MAPT (0.46) KDM4EHPGDMAPTMEN1KMT2A
SCHEMBL29307868 0.85 KMT2A (0.42) ALDH1A1KDM4EHPGDMAPTMEN1
SCHEMBL29307867 0.85 KLK7 (0.51) ALDH1A1KDM4EHPGDMAPTMEN1
SCHEMBL29307851 0.85 MAPT (0.46) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL29307847 0.84 SMN1; SMN2 (0.39) ALDH1A1KDM4EHPGDMAPTMEN1
SCHEMBL29307904 0.84 MAPT (0.47) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL29307843 0.82 NPC1 (0.47) ALDH1A1KDM4EHPGDMAPTMEN1
SCHEMBL29307844 0.80 RAC1 (0.47) ALDH1A1KDM4EHPGDMAPTMEN1
SCHEMBL29307846 0.79 RAC1 (0.43) ALDH1A1KDM4EHPGDMAPTHSD17B10

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-12041850-B2 Luminescent compounds Chromatwist Limited (GB) 2024-07-16 — — 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-12041850-B2 Luminescent compounds AHR, ARNT, CYCS ALDH1A1 2463/4885KDM4E 2504/4885HPGD 492/4885

“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.

Send feedback