SCHEMBL28544986

SCHEMBL28544986

CCOC(=O)C(C(C)C)N1CCC(Oc2ccnc3ccc(F)cc23)CC1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 20/20 0.54
CYP3A4 P08684 1/20 0.47

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
SCHEMBL24089856 0.91 IDO1 (0.55) IDO1CYP3A4
SCHEMBL17729183 0.89 IDO1 (0.62) IDO1
SCHEMBL28553379 0.89 IDO1 (0.56) IDO1CYP3A4
SCHEMBL23680441 0.84 IDO1 (0.61) IDO1
SCHEMBL17729174 0.83 IDO1 (0.64) IDO1CYP3A4
SCHEMBL17729211 0.83 IDO1 (0.64) IDO1
SCHEMBL17729139 0.83 IDO1 (0.53) IDO1CYP3A4
SCHEMBL23707523 0.82 IDO1 (0.50) IDO1CYP3A4
SCHEMBL17740948 0.82 IDO1 (0.64) IDO1CYP3A4
SCHEMBL22047855 0.81 IDO1 (0.57) IDO1CYP3A4

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
CN-107427499-B Immunomodulator 弗莱塞斯生物科学公司 2021-04-16 CN disclosed