SCHEMBL30764705

SCHEMBL30764705

O=C(Cc1ccc(Cl)cc1)N1CC2(CN(Cc3ccccc3OC(F)(F)F)C2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.45
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 1/20 0.44
HSD11B1 P28845 1/20 0.44
CYP2C19 P33261 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
USP2 O75604 1/20 0.41
TSHR P16473 1/20 0.41
GFER P55789 1/20 0.41
ATM Q13315 1/20 0.41
CCR8 P51685 3/20 0.41
KCNH2 Q12809 3/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MGLL Q99685 1/20 0.40
GPR183 P32249 1/20 0.39
CYP2D6 P10635 1/20 0.39
CHRM2 P08172 1/20 0.39
GHSR Q92847 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
SCHEMBL30764723 0.92 KDM4E (0.46) EPHX2KDM4EALDH1A1ALOX15HSD11B1
SCHEMBL30764707 0.80 HSD11B1 (0.55) KDM4EALDH1A1HSD11B1CYP2C19GFER
SCHEMBL30764745 0.75 SIGMAR1 (0.53) KDM4EALDH1A1ALOX15HSD11B1CYP2C19
SCHEMBL30764749 0.74 HSD11B1 (0.49) HSD11B1CYP2C19GFERATMKCNH2
SCHEMBL5391243 0.74 CCR8 (0.58) KDM4EALDH1A1ALOX15HSD11B1CYP2C19
SCHEMBL30764735 0.74 HSD11B1 (0.51) ALDH1A1HSD11B1GFERATMMEN1
SCHEMBL30764758 0.73 KDM4E (0.59) KDM4EALDH1A1HSD11B1GFERATM
Trifluoroacetic Acid SCHEMBL5434664 0.73 CCR8 (0.52) KDM4EALDH1A1ALOX15HSD11B1CYP2C19
Trifluoroacetic Acid SCHEMBL5428442 0.73 CCR8 (0.54) KDM4EALDH1A1ALOX15HSD11B1PTGDR2
SCHEMBL30764753 0.73 HSD11B1 (0.46) HSD11B1CYP2C19GFERATMMEN1

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