SCHEMBL28440940

SCHEMBL28440940

CCN(c1ccc(-n2cccc2C(=O)O)cc1NC(=O)Nc1ccc(C)cc1)C1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 20/20 0.63

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
SCHEMBL28896935 0.93 IDO1 (0.58) IDO1
SCHEMBL28442485 0.92 IDO1 (0.53) IDO1
SCHEMBL23658938 0.92 IDO1 (0.57) IDO1
SCHEMBL23647765 0.91 IDO1 (0.65) IDO1
SCHEMBL28435093 0.89 IDO1 (0.50) IDO1
SCHEMBL28434319 0.87 IDO1 (0.56) IDO1
SCHEMBL23658937 0.86 IDO1 (0.51) IDO1
SCHEMBL23647770 0.86 IDO1 (0.47) IDO1
SCHEMBL28406844 0.84 IDO1 (0.61) IDO1
SCHEMBL28443050 0.84 IDO1 (0.48) IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111153846-B Pyrrole compound, preparation method thereof, pharmaceutical composition and application CHINA PHARMACEUTICAL UNIVERSITY (CN) 2021-08-31 — — CN claimed
CN-111153846-A Pyrrole compound, preparation method thereof, pharmaceutical composition and application 中国药科大学 2020-05-15 — — CN claimed
CN-111153846-B Pyrrole compound, preparation method thereof, pharmaceutical composition and application CHINA PHARMACEUTICAL UNIVERSITY (CN) 2021-08-31 — — CN disclosed
CN-111153846-A Pyrrole compound, preparation method thereof, pharmaceutical composition and application 中国药科大学 2020-05-15 — — CN disclosed
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