SCHEMBL20175775

SCHEMBL20175775

OB(O)c1ccc2c(c1)c1ccccc1n2-c1cc2cccc3c(F)cc4cccc1c4c23

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ALDH1A1 P00352 1/20 0.31
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31

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
SCHEMBL20175773 0.82 CA1 (0.41) CA1CA2ALDH1A1IDO1TDO2
SCHEMBL29888544 0.80 CA1 (0.42) CA1CA2ALDH1A1
SCHEMBL3664181 0.80 CA1 (0.42) CA1CA2ALDH1A1
SCHEMBL29552193 0.80 CA1 (0.42) CA1CA2ALDH1A1
SCHEMBL27365577 0.78 L3MBTL1 (0.43) ALDH1A1
SCHEMBL15480385 0.76 CRHBP (0.34) CA1CA2ALDH1A1IDO1TDO2
SCHEMBL21975047 0.73 ALDH1A1 (0.41) CA1CA2ALDH1A1
SCHEMBL25118981 0.72 ALDH1A1 (0.35) CA1CA2ALDH1A1
SCHEMBL18525478 0.72 KDM4E (0.52) CA1CA2ALDH1A1
SCHEMBL21862072 0.72 CA1 (0.42) CA1CA2ALDH1A1

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-20180141957-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-05-24 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-20180141957-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF PIEZO1, OCIAD1, LEF1 CA1 1041/4885CA2 1260/4885ALDH1A1 486/4885

“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.