SCHEMBL19959796

SCHEMBL19959796

S=P(c1ccncc1)(c1ccc2cccnc2c1)c1cccc2nc3c4ccccc4c4ccccc4n3c12

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL19959841 0.96 PDE10A (0.33) PDE10AALDH1A1
SCHEMBL19959792 0.89 KDM4E (0.31) PDE10AALDH1A1
SCHEMBL19959778 0.89
SCHEMBL19965896 0.86 CYP3A4 (0.35) PDE10AALDH1A1
SCHEMBL19959786 0.86 CYP3A4 (0.32) PDE10AALDH1A1
SCHEMBL19959800 0.86 KDM4E (0.31) ALDH1A1
SCHEMBL19959818 0.86 BCL2 (0.33) PDE10AALDH1A1
SCHEMBL19959838 0.85 KDM4E (0.34) PDE10AALDH1A1
SCHEMBL19959839 0.85 KDM4E (0.34) ALDH1A1
SCHEMBL19959807 0.84 KDM4E (0.34) PDE10AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10700289-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2020-06-30 US disclosed
US-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-15 US disclosed
US-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-15 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 (2 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-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 PDE10A 3080/4885ALDH1A1 750/4885
US-10700289-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 PDE10A 3080/4885ALDH1A1 750/4885

“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.