SCHEMBL30717416

SCHEMBL30717416

CN1CC2CCC(C1)N2c1nc2c(s1)CN(C(=O)NC1CCC(F)(F)CC1)C2

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.36
EPHX2 P34913 1/20 0.36
SMO Q99835 3/20 0.35
DRD3 P35462 9/20 0.35
DRD2 P14416 7/20 0.35
NAMPT P43490 2/20 0.35
KDM1A O60341 1/20 0.33
CSNK1D P48730 1/20 0.31
CSNK1E P49674 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
SCHEMBL30717343 0.91 GRM5 (0.44) GRM5EPHX2SMODRD3DRD2
SCHEMBL30717563 0.91 KDM4E (0.38) SMO
SCHEMBL30717358 0.87 GRM5 (0.36) GRM5EPHX2SMODRD3DRD2
SCHEMBL30717540 0.84 CYP1A2 (0.35) GRM5DRD3DRD2
SCHEMBL30717542 0.82 POLB (0.40) GRM5
SCHEMBL30790843 0.78 NAMPT (0.42) EPHX2SMONAMPTKDM1ACSNK1D
SCHEMBL30717480 0.78 GRM5 (0.44) GRM5EPHX2SMODRD3DRD2
SCHEMBL30717411 0.78 GRM5 (0.43) GRM5DRD3
SCHEMBL30717559 0.77 HTT (0.36)
SCHEMBL30717474 0.74 CHRM4 (0.38) GRM5

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
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 2029/4885EPHX2 745/4885SMO 1465/4885

“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.