SCHEMBL22379751

SCHEMBL22379751

N#Cc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2c(C#N)cccc2-n2c3ccccc3c3cc(C#N)ccc32)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.33
HRH1 P35367 1/20 0.32
HTR6 P50406 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PGR P06401 2/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL26613805 1.00 DHFR (0.33) DHFRHRH1HTR6KDM4EATM
SCHEMBL22378331 0.96 KDM4E (0.34) DHFRHRH1HTR6KDM4EATM
SCHEMBL26614290 0.96 KDM4E (0.34) DHFRHRH1HTR6KDM4EATM
SCHEMBL22379108 0.96 KDM4E (0.34) DHFRHRH1HTR6KDM4EATM
SCHEMBL22378412 0.96 KDM4E (0.34) DHFRHRH1HTR6KDM4EATM
SCHEMBL26613779 0.95 HRH1 (0.32) DHFRHRH1HTR6GRIN1GRIN2B
SCHEMBL22378951 0.95 HRH1 (0.32) DHFRHRH1HTR6GRIN1GRIN2B
SCHEMBL22378613 0.95 KDM4E (0.35) DHFRKDM4EATML3MBTL1PGR
SCHEMBL21599609 0.94 KDM4E (0.36) DHFRHRH1HTR6KDM4EATM
SCHEMBL21599856 0.94 KDM4E (0.36) DHFRHRH1HTR6KDM4EATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-10-24 US disclosed
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-10-24 US disclosed
US-20200274074-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-08-27 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 (2 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-20200274074-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CYP1A1, CRY2 DHFR 607/4885HRH1 835/4885HTR6 2325/4885
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same CRY1, CYP1A1, CRY2 DHFR 607/4885HRH1 835/4885HTR6 2325/4885

“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.