SCHEMBL22563587

SCHEMBL22563587

Cc1cc(C)nc(-c2c(-n3c4ccccc4c4ccc(-c5cc(C#N)cc(C#N)c5)cc43)cc(C#N)cc2-n2c3ccccc3c3ccc(-c4cc(C#N)cc(C#N)c4)cc32)n1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.36
PTGER4 P35408 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
CHEK1 O14757 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
ELANE P08246 1/20 0.32

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
SCHEMBL22563588 0.94 CHEK1 (0.36) ABCG2CHEK1IRAK4
SCHEMBL22563368 0.94 ABCG2 (0.43) ABCG2PTGER4MEN1KMT2A
SCHEMBL23487620 0.94 ABCG2 (0.35) ABCG2PTGER4MEN1KMT2AATM
SCHEMBL22563500 0.94 ABCG2 (0.41) ABCG2PTGER4MEN1KMT2AATM
SCHEMBL23487261 0.92 ABCG2 (0.44) ABCG2MEN1KMT2AATM
SCHEMBL19943047 0.91 PTGER4 (0.36) PTGER4MEN1KMT2AATMCHEK1
SCHEMBL23487781 0.91 ABCG2 (0.38) ABCG2PTGER4MEN1KMT2AATM
SCHEMBL19909110 0.90 IRAK4 (0.33) PTGER4MEN1KMT2AATMIRAK4
SCHEMBL22563570 0.90 ABCG2 (0.43) ABCG2MEN1KMT2AATMCHEK1
SCHEMBL22563516 0.89 ABCG2 (0.37) ABCG2PTGER4MEN1KMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 US disclosed
EP-3580300-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP 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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 ABCG2 2612/4885PTGER4 1486/4885MEN1 2472/4885

“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.