SCHEMBL27410795

SCHEMBL27410795

CC(C)NC(=O)[C@@H]1COCCN1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.45
DPP7 Q9UHL4 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
ACACB O00763 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PKM P14618 1/20 0.35
SSTR4 P31391 1/20 0.34
CD274 Q9NZQ7 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRM5 P08912 1/20 0.30
CHRM3 P20309 1/20 0.30
PSMB9 P28065 2/20 0.30

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
SCHEMBL15572634 1.00 CTSC (0.45) CTSCDPP7CHRNB2CHRNB4CHRNA3
SCHEMBL23866599 1.00 CTSC (0.45) CTSCDPP7CHRNB2CHRNB4CHRNA3
SCHEMBL27042548 0.83 CTSC (0.41) CTSCDPP7ACACBSMN1; SMN2SSTR4
SCHEMBL27042542 0.83 CTSC (0.41) CTSCDPP7ACACBSMN1; SMN2SSTR4
SCHEMBL1442858 0.80 CTSC (0.40) CTSCCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL27410797 0.80 CTSC (0.40) CTSCCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL1442856 0.80 CTSC (0.40) CTSCCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL23866604 0.79 CTSC (0.40) CTSCACACBCD274
SCHEMBL25039138 0.77 DPP7 (0.46) CTSCDPP7CHRNB2CHRNB4CHRNA3
SCHEMBL20418559 0.77 DPP7 (0.46) CTSCDPP7CHRNB2CHRNB4CHRNA3

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-2024100139-A1 USE OF IFN-I ACTIVITY AS A BIOMARKER FOR TLR INHIBITOR TREATMENT MERCK PATENT GMBH (DE) 2024-05-16 WO disclosed