SCHEMBL22563585

SCHEMBL22563585

Cc1cccc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc(-n3c4ccccc4c4cc(-c5cccc(C)c5)ccc43)c2C#N)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.47
ADORA1 P30542 2/20 0.47
HPGD P15428 2/20 0.40
KDM4E B2RXH2 2/20 0.40
PPARG P37231 1/20 0.40
NCOA2 Q15596 1/20 0.40
NCOA1 Q15788 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
SQOR Q9Y6N5 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 2/20 0.37
KDM4A O75164 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
NR1I3 Q14994 1/20 0.36
F2 P00734 1/20 0.35

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
SCHEMBL21279077 0.97 ADORA2A (0.46) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL23487777 0.97 ADORA2A (0.49) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL23487670 0.94 HPGD (0.40) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL19942680 0.94 ADORA2A (0.41) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL23487308 0.93 ADORA1 (0.46) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL19909431 0.93 ADORA2A (0.47) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL22563685 0.92 KDM4E (0.43) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL22563547 0.92 SQOR (0.40) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL23487307 0.91 ADORA2A (0.42) ADORA2AADORA1HPGDKDM4EPPARG
SCHEMBL21108797 0.91 ADORA1 (0.43) ADORA2AADORA1HPGDKDM4EPPARG

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 ADORA2A 4354/4885ADORA1 4564/4885HPGD 1547/4885

“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.