SCHEMBL30717375

SCHEMBL30717375

O=C(CC1CCCC1)N1CCc2nc(N3CCNC[C@@H]3CO)sc2C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 12/20 0.42
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CYP2D6 P10635 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
NAMPT P43490 1/20 0.31
UCHL1 P09936 1/20 0.31
MAPK14 Q16539 1/20 0.31
SIGMAR1 Q99720 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
SCHEMBL30717409 1.00 GRM5 (0.42) GRM5ADORA2AADORA1NPC1RAB9A
Trifluoroacetic Acid SCHEMBL30717702 0.94 GRM5 (0.40) GRM5ADORA2AADORA1NPC1RAB9A
Trifluoroacetic Acid SCHEMBL30717593 0.94 GRM5 (0.40) GRM5ADORA2AADORA1NPC1RAB9A
SCHEMBL31748855 0.85 ADORA2A (0.47) GRM5ADORA2AADORA1NPC1RAB9A
SCHEMBL30717359 0.79 GRM5 (0.45) GRM5ADORA2AADORA1NPC1RAB9A
SCHEMBL30717403 0.79 GRM5 (0.44) GRM5ADORA2AADORA1NPC1RAB9A
SCHEMBL30717555 0.79 GRM5 (0.44) GRM5ADORA2AADORA1NPC1RAB9A
SCHEMBL30717316 0.77 ADORA2A (0.42) GRM5ADORA2AADORA1NPC1RAB9A
SCHEMBL30717530 0.77 GRM5 (0.46) GRM5ADORA2AADORA1NPC1RAB9A
SCHEMBL30717497 0.77 GRM5 (0.45) GRM5ADORA2AADORA1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250388604-A1 Compounds and Their Use as PDE4 Activators MIRONID LIMITED (GB) 2025-12-25 US claimed
EP-4572762-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2025-06-25 EP claimed
WO-2024038128-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS MIRONID LIMITED (GB) 2024-02-22 WO claimed
US-20250388604-A1 Compounds and Their Use as PDE4 Activators MIRONID LIMITED (GB) 2025-12-25 US disclosed
EP-4572762-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2025-06-25 EP disclosed
WO-2024038128-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS MIRONID LIMITED (GB) 2024-02-22 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-20250388604-A1 Compounds and Their Use as PDE4 Activators PDE4A, PDE7A, PDE4B GRM5 2029/4885ADORA2A 67/4885ADORA1 113/4885

“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.