SCHEMBL25944898

SCHEMBL25944898

CCCc1ccc(C(C)C)c(F)c1C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.33
METAP2 P50579 1/20 0.33
F2RL1 P55085 6/20 0.32
EIF4A3 P38919 1/20 0.30
CTSL P07711 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30

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
SCHEMBL14964461 0.85 EIF4A3 (0.35) METAP2EIF4A3
SCHEMBL18364549 0.80 CTSL (0.37) METAP2CTSLCTSSCTSK
SCHEMBL27342165 0.79 GABRA1 (0.35) EIF4A3CTSSCTSK
SCHEMBL8097072 0.76 METAP2 (0.35) METAP2F2RL1CTSLCTSSCTSK
SCHEMBL24319896 0.75 LMNA (0.38) EIF4A3
SCHEMBL28940400 0.74
SCHEMBL22336230 0.73 METAP2 (0.34) METAP2CTSLCTSSCTSK
SCHEMBL15417382 0.73 EIF4A3 (0.35) EIF4A3
SCHEMBL18364604 0.73 CTSL (0.38) CTSLCTSSCTSK
SCHEMBL20622503 0.72 EIF4A3 (0.40) EIF4A3

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-3500556-B1 PYRIDINE-1-OXIDE DERIVATIVES AND THEIR USE AS FACTOR XIA INHIBITORS MERCK SHARP & DOHME LLC (US) 2023-08-02 EP disclosed