SCHEMBL30764757

SCHEMBL30764757

COc1cc(OC)nc(CN2CC3(C2)CN(C(=O)Cc2ccc(Cl)cc2)C3)n1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.46
GHSR Q92847 2/20 0.44
CHRM2 P08172 1/20 0.44
CD274 Q9NZQ7 5/20 0.42
PDCD1LG2 Q9BQ51 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
FAAH O00519 2/20 0.38
PDCD1 Q15116 1/20 0.38
GFER P55789 1/20 0.38
ATM Q13315 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL30764737 0.89 HSD11B1 (0.46) HSD11B1GHSRCHRM2CD274PDCD1LG2
SCHEMBL30764702 0.84 GHSR (0.46) HSD11B1GHSRCHRM2CD274PDCD1LG2
SCHEMBL30764715 0.81 HSD11B1 (0.51) HSD11B1GHSRCHRM2MEN1KMT2A
SCHEMBL30764755 0.79 GAA (0.54) HSD11B1SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL30764707 0.78 HSD11B1 (0.55) HSD11B1SMN1; SMN2MEN1KMT2AGFER
SCHEMBL30764717 0.76 HSD11B1 (0.46) HSD11B1GHSRCHRM2CD274PDCD1LG2
SCHEMBL30764763 0.76 HSD11B1 (0.46) HSD11B1GHSRCHRM2SMN1; SMN2KMT2A
SCHEMBL30764735 0.76 HSD11B1 (0.51) HSD11B1MEN1KMT2AFAAHGFER
SCHEMBL30764719 0.76 SMN1; SMN2 (0.53) HSD11B1GHSRCHRM2SMN1; SMN2ALDH1A1
SCHEMBL30764758 0.73 KDM4E (0.59) HSD11B1GHSRCHRM2SMN1; SMN2MEN1

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
EP-4568968-A1 (AZA)SPIROHEPTANE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS Remynd N.V. (BE) 2025-06-18 EP disclosed
WO-2024033479-A1 (AZA)SPIROHEPTANE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS REMYND N.V. (BE) 2024-02-15 WO disclosed