SCHEMBL21396717

SCHEMBL21396717

N#Cc1ccc(N2c3ccccc3C3(c4ccccc4Oc4ccccc43)c3ccccc32)c(-c2cccnc2N2c3ccccc3C3(c4ccccc4Oc4ccccc43)c3ccccc32)c1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.31
PDK2 Q15119 1/20 0.31
USP30 Q70CQ3 1/20 0.30
ABCC9 O60706 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
BRD4 O60885 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
SCHEMBL21396739 0.91 PDK2 (0.36) EGLN1PDK2USP30NPSR1BRD4
SCHEMBL21396793 0.90 USP30 (0.33) USP30BRD4
SCHEMBL21397202 0.84 PGR (0.38) EGLN1PDK2USP30ABCC9NPSR1
SCHEMBL21397171 0.83 ABCC9 (0.37) ABCC9
SCHEMBL22065909 0.81 HCRTR1 (0.32) PDK2NPSR1
SCHEMBL21396729 0.79 ABCC9 (0.32) PDK2USP30ABCC9
SCHEMBL22147510 0.78 ABCG2 (0.36) ABCC9
SCHEMBL21397045 0.77 KMT2A (0.41) USP30BRD4
SCHEMBL18361011 0.77 CASP3 (0.40) PDK2
SCHEMBL21396640 0.75 BRD4 (0.36) EGLN1USP30NPSR1BRD4

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-20190296247-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-26 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-20190296247-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SLC25A21, SLCO4C1, SLC18A1 EGLN1 727/4885PDK2 143/4885USP30 3777/4885

“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.