SCHEMBL27254722

SCHEMBL27254722

COC(CNC(=O)Nc1c2c(nn1-c1cc(C)c(F)c(C)c1)CCN(C)C2)OC

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 18/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.32

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
SCHEMBL21175362 0.90 NTRK1 (0.38) NTRK1ALDH1A1
SCHEMBL31692395 0.83 C5AR1 (0.38) NTRK1
SCHEMBL31692230 0.83 NTRK1 (0.41) NTRK1
SCHEMBL25267995 0.81 ALDH1A1 (0.35) NTRK1ALDH1A1HPGD
SCHEMBL21175197 0.81 ALDH1A1 (0.35) NTRK1ALDH1A1HPGD
SCHEMBL21175270 0.81 ALDH1A1 (0.36) NTRK1ALDH1A1
SCHEMBL21175154 0.80 NTRK1 (0.41) NTRK1ALDH1A1HPGD
SCHEMBL21175241 0.79 ALDH1A1 (0.37) NTRK1ALDH1A1
SCHEMBL21183751 0.79 NTRK1 (0.39) NTRK1HPGD
SCHEMBL20014817 0.78 NTRK1 (0.34) NTRK1ALDH1A1

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-2024137426-A1 PROCESS TO MAKE GLP1 RA AND INTERMEDIATES THEREFOR ELI LILLY AND COMPANY (US) 2024-06-27 — — WO disclosed
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