SCHEMBL12503512

SCHEMBL12503512

Cc1ccc2c(c1)oc1c3cc4c(cc3sc21)c1sc2cc(C)ccc2c1n4-c1ccc(O)cc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.38
HTT P42858 1/20 0.33
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
ESR1 P03372 4/20 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
SCHEMBL12412809 0.94 ALDH1A1 (0.33) ESR2HTTALDH1A1GAAHPGD
SCHEMBL12504744 0.93 ESR2 (0.41) ESR2HTTESR1
SCHEMBL12504750 0.90 ESR2 (0.35) ESR2HTTGAAESR1
SCHEMBL12412808 0.87 ALDH1A1 (0.33) ESR2HTTALDH1A1GAAHPGD
SCHEMBL12503566 0.87 HTT (0.40) ESR2HTTALDH1A1GAAESR1
SCHEMBL12412805 0.86 ESR2 (0.34) ESR2HTTALDH1A1
SCHEMBL12503939 0.86 ESR2 (0.34) ESR2HTTESR1
SCHEMBL12504728 0.85 ESR2 (0.35) ESR2HTTESR1
SCHEMBL12413053 0.85 ALDH1A1 (0.33) ESR2HTTALDH1A1GAAHPGD
SCHEMBL12503515 0.84 ESR2 (0.35) ESR2ESR1

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-20110166362-A1 NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-07 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-20110166362-A1 NOVEL COMPOUND AND ORGANIC SEMICONDUCTOR MATERIAL SCLY, MSRB3, SOD1 ESR2 75/4885HTT 4130/4885ALDH1A1 2760/4885

“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.