SCHEMBL29337105

SCHEMBL29337105

C[C@@H](N)c1cccc(CO)n1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 15/20 0.44
CCR1 P32246 1/20 0.38

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
SCHEMBL2936127 1.00 IRAK4 (0.44) IRAK4CCR1
SCHEMBL4047127 0.84 GABRA1 (0.42) IRAK4CCR1
SCHEMBL20416692 0.82 CCR1 (0.39) IRAK4CCR1
SCHEMBL19085083 0.82 CCR1 (0.39) IRAK4CCR1
SCHEMBL28404709 0.81 IRAK4 (0.37) IRAK4
SCHEMBL20738460 0.81 CCR1 (0.42) IRAK4CCR1
SCHEMBL20400486 0.81 CCR1 (0.38) IRAK4CCR1
SCHEMBL20442097 0.80 IRAK4 (0.38) IRAK4CCR1
SCHEMBL20436438 0.79 TSHR (0.37) IRAK4CCR1
SCHEMBL522063 0.79 CYP1A2 (0.38) IRAK4

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-3365334-B1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMA CO LTD (JP) 2024-07-17 EP disclosed