SCHEMBL23021781

SCHEMBL23021781

CC(O)c1cccc2[nH]ncc12

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 5/20 0.60
▸ NOS1 P29475 4/20 0.50
▸ AXL P30530 2/20 0.50
▸ TRPV1 Q8NER1 4/20 0.46
▸ METAP2 P50579 1/20 0.46
▸ JAK2 O60674 1/20 0.44
▸ JAK1 P23458 1/20 0.44
▸ MET P08581 1/20 0.41

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
SCHEMBL2611042 0.85 IDO1 (0.55) IDO1NOS1AXLTRPV1METAP2
SCHEMBL22079091 0.82 IDO1 (0.53) IDO1NOS1AXLTRPV1METAP2
SCHEMBL20353958 0.82 IDO1 (0.53) IDO1NOS1AXLTRPV1METAP2
SCHEMBL28592498 0.82 IDO1 (0.53) IDO1NOS1AXLTRPV1METAP2
SCHEMBL24630927 0.81 IDO1 (0.59) IDO1NOS1AXLTRPV1JAK2
SCHEMBL27550239 0.80 IDO1 (0.55) IDO1NOS1AXLTRPV1METAP2
SCHEMBL30162490 0.80 IDO1 (0.55) IDO1NOS1AXLTRPV1METAP2
SCHEMBL24285801 0.79 IDO1 (0.50) IDO1NOS1AXLTRPV1METAP2
SCHEMBL24368019 0.79 IDO1 (0.54) IDO1NOS1AXLTRPV1METAP2
SCHEMBL21540839 0.79 IDO1 (0.54) IDO1NOS1AXLTRPV1METAP2

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
WO-2021032148-A1 AMINOPYRAZINE COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF BEIGENE, LTD. (KY) 2021-02-25 — — WO disclosed
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