SCHEMBL28803369

SCHEMBL28803369

NC(=O)O[C@@H](Cc1ccccc1)C(=O)NCc1cccc(Cl)c1F

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 6/20 0.44
▸ ALDH1A1 P00352 1/20 0.41
▸ PPARG P37231 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ P2RX7 Q99572 2/20 0.39
▸ MMP8 P22894 1/20 0.39

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
SCHEMBL28803370 1.00 CFD (0.44) CFDALDH1A1PPARGPPARAP2RX7
SCHEMBL28803298 0.86 CFD (0.48) CFDALDH1A1P2RX7
SCHEMBL28803299 0.86 CFD (0.48) CFDALDH1A1P2RX7
SCHEMBL28803147 0.84 SCN9A (0.48) CFDALDH1A1P2RX7
SCHEMBL28803272 0.84 HDAC8 (0.44) CFDALDH1A1P2RX7
SCHEMBL28803202 0.84 HDAC8 (0.44) CFDALDH1A1P2RX7
SCHEMBL28803205 0.83 CFD (0.46) CFDALDH1A1P2RX7
SCHEMBL28803388 0.83 CFD (0.44) CFDALDH1A1P2RX7
SCHEMBL28803389 0.83 CFD (0.44) CFDALDH1A1P2RX7
SCHEMBL28803203 0.83 CFD (0.46) CFDALDH1A1P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115490751-A Factor D inhibitors 拜奥克里斯特制药公司 2022-12-20 — — CN disclosed
CN-109121414-B Benzopyrazole compounds and analogs thereof 拜奥克里斯特制药公司 2022-07-05 — — CN disclosed
Send feedback