SCHEMBL22157128

SCHEMBL22157128

N#Cc1c(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)ccc(-c2cc(F)cc(F)c2)c1-n1c2ccccc2c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SQOR Q9Y6N5 2/20 0.35
ADORA1 P30542 8/20 0.34
ADORA2A P29274 5/20 0.34
KDM4E B2RXH2 3/20 0.34
HPGD P15428 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
SSTR2 P30874 5/20 0.33
ADORA2B P29275 2/20 0.32
MAPK1 P28482 2/20 0.31
HSD17B10 Q99714 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP3A4 P08684 2/20 0.30
CYP2C9 P11712 2/20 0.30
CYP2C19 P33261 2/20 0.30
SSTR3 P32745 1/20 0.30
KCNH2 Q12809 1/20 0.30
ALDH1A1 P00352 2/20 0.30
MEN1 O00255 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
SCHEMBL22157131 0.97 ADORA1 (0.35) SQORADORA1ADORA2AKDM4EHPGD
SCHEMBL22155953 0.94 SQOR (0.35) SQORADORA1ADORA2AKDM4EHPGD
SCHEMBL22157130 0.91 ADORA1 (0.35) SQORADORA1ADORA2AKDM4EHPGD
SCHEMBL22157260 0.91 SSTR2 (0.35) SQORADORA1ADORA2AKDM4EHPGD
SCHEMBL22158499 0.89 SSTR2 (0.33) SQORSSTR2CYP3A4CYP2C9CYP2C19
SCHEMBL22156554 0.89 HPGD (0.39) SQORADORA1ADORA2AKDM4EHPGD
SCHEMBL22157178 0.89 SQOR (0.33) SQORADORA1ADORA2AKDM4EHPGD
SCHEMBL22155955 0.88 SSTR2 (0.36) SQORADORA1ADORA2AKDM4EHPGD
SCHEMBL22157288 0.88 SQOR (0.32) SQORADORA1ADORA2AKDM4EHPGD
SCHEMBL21546956 0.86 CYP1A2 (0.43) ADORA1ADORA2AKDM4EHPGDADORA2B

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 SQOR 302/4885ADORA1 4534/4885ADORA2A 4520/4885

“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.