SCHEMBL22157335

SCHEMBL22157335

N#Cc1c(-n2c3ccc(-c4ccc(-c5ccccc5)nc4)cc3c3cc(-c4ccc(-c5ccccc5)nc4)ccc32)ccc(-c2c(F)c(F)c(F)c(F)c2F)c1-n1c2ccc(-c3ccc(-c4ccccc4)nc3)cc2c2cc(-c3ccc(-c4ccccc4)nc3)ccc21

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.33
ADORA1 P30542 3/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
SLC6A9 P48067 1/20 0.33
SQOR Q9Y6N5 2/20 0.32
ALOX5AP P20292 2/20 0.32
FEN1 P39748 2/20 0.32
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MTOR P42345 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
SCHEMBL22156666 0.93 KDM4E (0.33) ADORA2AADORA1KDM4EHPGDNPSR1
SCHEMBL22157355 0.93 ADORA2A (0.33) ADORA2AADORA1KDM4EHPGDNPSR1
SCHEMBL22157331 0.92 SQOR (0.33) ADORA2AADORA1KDM4EHPGDNPSR1
SCHEMBL22155978 0.92 ALOX5AP (0.35) ADORA2AADORA1KDM4EHPGDNPSR1
SCHEMBL22158545 0.89 ALOX5AP (0.34) ADORA2AADORA1KDM4EHPGDNPSR1
SCHEMBL22157239 0.89 ADORA2A (0.32) ADORA2AADORA1SQOR
SCHEMBL22158520 0.89 KDM4E (0.38) ADORA2AADORA1KDM4EHPGDNPSR1
SCHEMBL21898753 0.87 KDM4E (0.34) ADORA2AADORA1KDM4EHPGDNPSR1
SCHEMBL22156665 0.87 ADORA1 (0.36) ADORA2AADORA1KDM4EHPGDNPSR1
SCHEMBL22156589 0.86 PDE9A (0.33) ADORA2AADORA1SQOR

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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 ADORA2A 4520/4885ADORA1 4534/4885KDM4E 4239/4885

“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.