SCHEMBL30454922

SCHEMBL30454922

c1coc(CNc2nc(NCc3ccc4c(c3)OCO4)nc3ccccc23)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.59
NPSR1 Q6W5P4 7/20 0.59
MAPK1 P28482 6/20 0.59
KDM4E B2RXH2 4/20 0.59
PDE5A O76074 2/20 0.59
USP1 O94782 1/20 0.56
WDR48 Q8TAF3 1/20 0.56
KMT2A Q03164 8/20 0.56
ALDH1A1 P00352 6/20 0.56
LMNA P02545 4/20 0.56
MEN1 O00255 4/20 0.56
TP53 P04637 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C19 P33261 1/20 0.56
HIF1A Q16665 1/20 0.56
HSD17B10 Q99714 1/20 0.56
SOS1 Q07889 3/20 0.55
HTT P42858 3/20 0.54

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
SCHEMBL30455311 0.83 MAPT (0.81) MAPTNPSR1MAPK1KDM4EPDE5A
SCHEMBL22342962 0.81 CTNNB1 (0.77) MAPTNPSR1MAPK1KDM4EPDE5A
SCHEMBL29490089 0.81 CTNNB1 (0.77) MAPTNPSR1MAPK1KDM4EPDE5A
SCHEMBL3114782 0.79 PDE5A (0.67) MAPTNPSR1MAPK1KDM4EPDE5A
SCHEMBL13192094 0.79 PDE5A (0.67) MAPTNPSR1MAPK1PDE5AUSP1
SCHEMBL14256686 0.79 PDE5A (0.55) MAPTNPSR1MAPK1KDM4EPDE5A
SCHEMBL30455233 0.78 MEN1 (0.58) MAPTNPSR1MAPK1KDM4EPDE5A
SCHEMBL30455471 0.78 MAPT (0.72) MAPTNPSR1MAPK1KDM4EPDE5A
SCHEMBL22343385 0.78 KMT2A (0.67) MAPTNPSR1MAPK1KDM4EKMT2A
SCHEMBL29490079 0.78 KMT2A (0.67) MAPTNPSR1MAPK1KDM4EKMT2A

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-20250051290-A1 NOVEL COMPOUND FOR IMPROVING SLEEP OR USE THEREOF UNIV AJOU IND ACADEMIC COOP FOUND (KR) 2025-02-13 US disclosed
WO-2023121429-A1 NOVEL COMPOUND FOR IMPROVING SLEEP OR USE THEREOF 아주대학교산학협력단 2023-06-29 WO 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-20250051290-A1 NOVEL COMPOUND FOR IMPROVING SLEEP OR USE THEREOF ADORA2A, HCRTR1, ADORA1 MAPT 4331/4885NPSR1 46/4885MAPK1 2480/4885

“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.