SCHEMBL30324512

SCHEMBL30324512

CC(C)(C)OC(=O)N1CC(C(F)(F)c2ccnc(C#N)c2)C1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 9/20 0.46
▸ JAK2 O60674 1/20 0.42
▸ JAK1 P23458 1/20 0.42
▸ RORC P51449 1/20 0.40
▸ GRM5 P41594 1/20 0.38
▸ SCN10A Q9Y5Y9 2/20 0.37
▸ EGLN2 Q96KS0 1/20 0.37

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
SCHEMBL24111414 1.00 GPR119 (0.46) GPR119JAK2JAK1RORCGRM5
SCHEMBL30324497 0.84 RORC (0.42) GPR119JAK2JAK1RORC
SCHEMBL23705964 0.80 GPR119 (0.49) GPR119JAK2JAK1GRM5EGLN2
SCHEMBL17729471 0.77 MAPT (0.52) GPR119RORC
SCHEMBL24111557 0.77 GPR119 (0.47) GPR119JAK2JAK1GRM5EGLN2
SCHEMBL30835998 0.76 SYK (0.43) GPR119RORCGRM5
SCHEMBL17541957 0.75 RORC (0.49) RORC
SCHEMBL20570727 0.75 RORC (0.49) GPR119RORC
SCHEMBL26105375 0.74 RORC (0.43) GPR119JAK2JAK1RORC
SCHEMBL23802575 0.74 GPR119 (0.49) GPR119RORCGRM5

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-4164654-A1 RIPK1 INHIBITORS AND METHODS OF USE Merck Sharp & Dohme LLC (US) 2023-04-19 — — EP disclosed
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