SCHEMBL19959846

SCHEMBL19959846

S=P(c1ccc2cccnc2c1)(c1ccnc2ccccc12)c1cccc2c3ccccc3n3c4ccccc4nc3c12

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL19959800 0.90 KDM4E (0.31) KDM4ELMNATP53POLBMAPT
SCHEMBL19959844 0.87 PTPN1 (0.31) CYP3A4KDM4ELMNATP53POLB
SCHEMBL19959852 0.87 KDM4E (0.33) CYP3A4KDM4ELMNATP53POLB
SCHEMBL19959857 0.87 KDM4E (0.33) CYP3A4KDM4ELMNATP53POLB
SCHEMBL19959818 0.82 BCL2 (0.33) CYP3A4KDM4ELMNATP53POLB
SCHEMBL19959845 0.82 KDM4E (0.36) CYP3A4KDM4ELMNATP53POLB
SCHEMBL19959801 0.80 KDM4E (0.37) CYP3A4KDM4ELMNATP53POLB
SCHEMBL19959934 0.80 KDM4E (0.37) CYP3A4KDM4ELMNATP53POLB
SCHEMBL19959797 0.80 BCL2 (0.31) CYP3A4KDM4ELMNATP53POLB
SCHEMBL19959885 0.79 KDM4E (0.34) CYP3A4KDM4ELMNATP53POLB

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 CYP3A4 106/4885KDM4E 1997/4885LMNA 3023/4885
US-10700289-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 CYP3A4 106/4885KDM4E 1997/4885LMNA 3023/4885

“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.