SCHEMBL24901070

SCHEMBL24901070

CCC1=CC(C)C[C@H](N)CC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
TLR4 O00206 1/20 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
SCHEMBL7593963 0.79
SCHEMBL4442242 0.71
SCHEMBL28254163 0.69 CA1 (0.32) NOS3NOS2
SCHEMBL18944207 0.69
SCHEMBL21253722 0.68 NOS3 (0.34) NOS3NOS2
SCHEMBL20726919 0.67 NOS3 (0.32) NOS3NOS2
SCHEMBL4015357 0.65
SCHEMBL14157769 0.64
SCHEMBL7592375 0.64
SCHEMBL24900948 0.64

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
EP-3381896-B1 BIPHENYL COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2023-01-18 EP disclosed