SCHEMBL20175795

SCHEMBL20175795

OB(O)c1ccc2c(c1)c1ccccc1n2-c1nc(-c2ccccc2)c2oc3ccc4ccccc4c3c2n1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
FYN P06241 1/20 0.33
MAPK3 P27361 1/20 0.33
AHR P35869 1/20 0.33
PAX8 Q06710 1/20 0.33
PTGER1 P34995 1/20 0.32
PTGES O14684 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL18852932 0.85 KDM4E (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26741876 0.84 KDM4E (0.37) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26742174 0.84 ABCG2 (0.39) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26741879 0.83 KDM4E (0.36) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL20175785 0.83 CA1 (0.35) CYP1A2PTGER1PTGESCA1CA2
SCHEMBL26742202 0.83 ABCG2 (0.34) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL18852817 0.82 KDM4E (0.37) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26741932 0.82 ABCG2 (0.34) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26742148 0.82 CYP1A2 (0.34) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26741934 0.82 ABCG2 (0.34) ABCG2CYP1A1CYP1A2FYNMAPK3

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 ABCG2 4346/4885CYP1A1 582/4885CYP1A2 1359/4885

“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.