SCHEMBL31056771

SCHEMBL31056771

COC(=O)c1ccc(C2CN(CC(F)F)CCN2C(=O)OCc2ccccc2)cc1C1CC1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 13/20 0.45
SIGMAR1 Q99720 13/20 0.45
PDE4B Q07343 1/20 0.43

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
SCHEMBL29324569 0.89 TMEM97 (0.47) TMEM97SIGMAR1PDE4B
SCHEMBL31056921 0.88 TMEM97 (0.48) TMEM97SIGMAR1PDE4B
SCHEMBL31056939 0.88 TMEM97 (0.46) TMEM97SIGMAR1PDE4B
SCHEMBL31056583 0.88 TMEM97 (0.46) TMEM97SIGMAR1PDE4B
SCHEMBL29324227 0.88 TMEM97 (0.46) TMEM97SIGMAR1PDE4B
SCHEMBL31056814 0.83 TMEM97 (0.42) TMEM97SIGMAR1PDE4B
SCHEMBL31056568 0.83 PDE4B (0.42) TMEM97SIGMAR1PDE4B
SCHEMBL8248090 0.76 TMEM97 (0.55) TMEM97SIGMAR1
SCHEMBL206142 0.75 TMEM97 (0.52) TMEM97SIGMAR1
SCHEMBL30930678 0.75 TMEM97 (0.58) TMEM97SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024148274-A1 COMPLEMENT INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2024-07-11 WO disclosed