SCHEMBL18958303

SCHEMBL18958303

OB(O)c1cccc2c3ccccc3n(-c3cccc(-c4cc(-c5ccccc5)cc(-c5ccccc5)n4)c3)c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ GAA P10253 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ COMT P21964 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ OPRD1 P41143 2/20 0.32
▸ AKR1C3 P42330 1/20 0.32
▸ AKR1C2 P52895 1/20 0.32
▸ AKR1C1 Q04828 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ MAPT P10636 2/20 0.32

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
SCHEMBL18958302 0.97 GAA (0.36) ADORA3ADORA2BADORA1KMT2AGAA
SCHEMBL17349141 0.92 ADORA3 (0.37) ADORA3ADORA2BADORA1KMT2AGAA
SCHEMBL17349168 0.92 ADORA3 (0.37) ADORA3ADORA2BADORA1KMT2AGAA
SCHEMBL18958306 0.91 MEN1 (0.39) ADORA3ADORA1KMT2AGAAMEN1
SCHEMBL18958301 0.90 MEN1 (0.38) ADORA3ADORA1KMT2AGAAMEN1
SCHEMBL18958294 0.89 KDM4E (0.36) ADORA3ADORA1KMT2AGAAMEN1
SCHEMBL18958291 0.88 COMT (0.44) KMT2AGAAMEN1COMTKDM4E
SCHEMBL30250426 0.88 COMT (0.44) KMT2AGAAMEN1COMTKDM4E
SCHEMBL18958659 0.86 ADORA3 (0.36) ADORA3ADORA2BADORA1KMT2AGAA
SCHEMBL18958293 0.86 ADORA3 (0.38) ADORA3ADORA2BADORA1KMT2AMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170170407-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD (KR) 2017-06-15 — — US disclosed
US-20170170407-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD (KR) 2017-06-15 — — 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-20170170407-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF OR10J3, OR51E2, ETV6 ADORA3 4520/4885ADORA2B 4546/4885ADORA1 4448/4885

“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.

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