SCHEMBL22378951

SCHEMBL22378951

N#Cc1cc(-c2cccc(-c3c(C#N)cccc3-n3c4ccccc4c4cc(C#N)ccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.32
HTR6 P50406 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
DHFR P00374 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 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
SCHEMBL26613779 1.00 HRH1 (0.32) HRH1HTR6RXFP1DHFRSMN1; SMN2
SCHEMBL22377821 0.96 RXFP1 (0.34) RXFP1DHFRSMN1; SMN2HIF1AGRIN1
SCHEMBL22379751 0.95 DHFR (0.33) HRH1HTR6DHFRSMN1; SMN2HIF1A
SCHEMBL26613805 0.95 DHFR (0.33) HRH1HTR6DHFRSMN1; SMN2HIF1A
SCHEMBL21599506 0.95 HRH1 (0.33) HRH1HTR6RXFP1SMN1; SMN2HIF1A
SCHEMBL21599502 0.95 HRH1 (0.33) HRH1HTR6RXFP1SMN1; SMN2HIF1A
SCHEMBL22378172 0.94 HRH1 (0.32) HRH1HTR6RXFP1
SCHEMBL22378331 0.93 KDM4E (0.34) HRH1HTR6DHFRSMN1; SMN2HIF1A
SCHEMBL22378412 0.93 KDM4E (0.34) HRH1HTR6DHFRSMN1; SMN2HIF1A
SCHEMBL22379108 0.93 KDM4E (0.34) HRH1HTR6DHFRSMN1; SMN2HIF1A

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 HRH1 835/4885HTR6 2325/4885RXFP1 3137/4885
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same CRY1, CYP1A1, CRY2 HRH1 835/4885HTR6 2325/4885RXFP1 3137/4885

“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.