SCHEMBL25360809

SCHEMBL25360809

N#Cc1c(N)nc(S)c(C#N)c1-c1ccc(OC2COC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 3/20 0.42
GAA P10253 1/20 0.42
ADORA1 P30542 11/20 0.41
ADORA2A P29274 4/20 0.41
ADORA2B P29275 5/20 0.40
RXFP1 Q9HBX9 4/20 0.40
MAPT P10636 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
HTR1B P28222 1/20 0.40
OPRK1 P41145 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
HSD17B10 Q99714 2/20 0.39
HPGD P15428 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL923971 0.91 ADORA2A (0.42) KDM4EALDH1A1GAAADORA1ADORA2A
SCHEMBL31378286 0.86 KDM4E (0.43) KDM4EALDH1A1GAAADORA1ADORA2A
SCHEMBL31378332 0.86 KDM4E (0.43) KDM4EALDH1A1GAAADORA1ADORA2A
SCHEMBL25361368 0.86 KDM4E (0.43) KDM4EALDH1A1GAAADORA1ADORA2A
SCHEMBL924056 0.85 ADORA2B (0.41) KDM4EALDH1A1GAAADORA1ADORA2A
SCHEMBL924057 0.85 ADORA2B (0.41) KDM4EALDH1A1GAAADORA1ADORA2A
SCHEMBL25362892 0.82 ADORA2B (0.45) KDM4EALDH1A1ADORA1ADORA2AADORA2B
SCHEMBL924038 0.81 KDM4E (0.38) KDM4EALDH1A1GAAADORA1ADORA2A
SCHEMBL924039 0.81 KDM4E (0.38) KDM4EALDH1A1GAAADORA1ADORA2A
SCHEMBL25362301 0.80 ADORA2B (0.55) KDM4EALDH1A1ADORA1ADORA2AADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250170112-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS LUCY THERAPEUTICS, INC. 2025-05-29 US disclosed
WO-2025038783-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS OR CHRONIC HEART FAILURE LUCY THERAPEUTICS, INC. (US) 2025-02-20 WO disclosed
EP-4479399-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Lucy Therapeutics, Inc. (US) 2024-12-25 EP disclosed
WO-2023158725-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS LUCY THERAPEUTICS, INC. (US) 2023-08-24 WO disclosed
WO-2023158725-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS LUCY THERAPEUTICS, INC. (US) 2023-08-24 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-20250170112-A1 ADENOSINE LIGANDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS ADORA2A, ADORA1, PDE7A KDM4E 3543/4885ALDH1A1 1355/4885GAA 428/4885

“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.