SCHEMBL24762515

SCHEMBL24762515

C=N/C(=C\C=C/C)c1cc(-c2ccc(-c3nc(-c4cccc(-c5ccccn5)c4)c(-c4ccccc4)nc3-c3ccccc3)cc2)cc(-c2ccccn2)n1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.32
▸ CNR1 P21554 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ HIF1A Q16665 3/20 0.31
▸ KAT6A Q92794 1/20 0.31
▸ GRM5 P41594 1/20 0.31
▸ MCL1 Q07820 2/20 0.30
▸ HSP90AA1 P07900 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
SCHEMBL25887036 0.96 HIF1A (0.34) CNR2KDM4ELMNAHTTSMN1; SMN2
SCHEMBL23176879 0.92 SIRT2 (0.36) KDM4ELMNAHTTSMN1; SMN2HSP90AA1
SCHEMBL21743331 0.90 HSP90AA1 (0.35) KDM4ELMNAHTTSMN1; SMN2HIF1A
SCHEMBL21861168 0.84 MCL1 (0.40) KDM4ELMNAHTTSMN1; SMN2MCL1
SCHEMBL19313649 0.82 TRPV1 (0.33) KDM4ELMNAHTTSMN1; SMN2HSP90AA1
SCHEMBL21935789 0.82 MAPK1 (0.30) —
SCHEMBL20169567 0.82 KAT6A (0.35) CNR1KDM4ELMNAHTTSMN1; SMN2
SCHEMBL22650171 0.77 KDM4E (0.36) CNR1KDM4ELMNAHTTSMN1; SMN2
SCHEMBL23161862 0.77 KDM4E (0.49) KDM4ELMNAHTTSMN1; SMN2HIF1A
SCHEMBL23161497 0.77 KDM4E (0.49) KDM4ELMNAHTTSMN1; SMN2HIF1A

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-20220393112-A1 Organic Semiconductor Layer, Organic Electronic Device Comprising the Same and Compounds Therefor NOVALED GMBH (DE) 2022-12-08 — — 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-20220393112-A1 Organic Semiconductor Layer, Organic Electronic Device Comprising the Same and Compounds Therefor SLC39A11, OR51E2, COMT CNR2 4669/4885CNR1 4501/4885KDM4E 1381/4885

“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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