SCHEMBL24801548

SCHEMBL24801548

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3nc(-c4cc(-c5ccccc5)cc5oc6cc7ccccc7cc6c45)c4ccccc4n3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.36
ESR1 P03372 2/20 0.32
ESR2 Q92731 2/20 0.32
SCN9A Q15858 1/20 0.31
CCNC P24863 1/20 0.31
CDK8 P49336 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
SCHEMBL24803034 0.99 NUDT1 (0.36) NUDT1ESR1ESR2SCN9ACCNC
SCHEMBL24802311 0.93 NUDT1 (0.38) NUDT1ESR1ESR2SCN9A
SCHEMBL24802322 0.92 NUDT1 (0.38) NUDT1ESR1ESR2SCN9A
SCHEMBL24801487 0.91 NUDT1 (0.37) NUDT1ESR1ESR2SCN9A
SCHEMBL24802752 0.90 NUDT1 (0.36) NUDT1ESR1ESR2SCN9A
SCHEMBL24801549 0.88 MEN1 (0.39)
SCHEMBL24801452 0.86 NUDT1 (0.37) NUDT1ESR1ESR2SCN9A
SCHEMBL24801466 0.86 MEN1 (0.35) ESR1ESR2
SCHEMBL23609990 0.85 NUDT1 (0.36) NUDT1ESR1ESR2SCN9A
SCHEMBL23609829 0.85 NUDT1 (0.42) NUDT1ESR1ESR2SCN9A

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-20220411411-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING ELEMENT, AND METHOD FOR PRODUCING ORGANIC LIGHT-EMITTING ELEMENT LT MATERIALS CO.,LTD. (KR) 2022-12-29 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-20220411411-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING ELEMENT, AND METHOD FOR PRODUCING ORGANIC LIGHT-EMITTING ELEMENT CRY1, ODC1, ORC3 NUDT1 515/4885ESR1 99/4885ESR2 489/4885

“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.