SCHEMBL8902155

SCHEMBL8902155

CCC1(C(=O)O)C2CC(Cc3ccc(F)c(F)c3)C(C#N)(C(=O)CN)C21

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.34
GRM3 Q14832 2/20 0.34
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL8892810 0.93 GRM2 (0.33) GRM2GRM3
SCHEMBL8892402 0.93 GRM2 (0.33) GRM2GRM3
SCHEMBL8892171 0.88 GRM2 (0.37) GRM2GRM3
SCHEMBL8892694 0.87
SCHEMBL8894509 0.87 TSHR (0.30) GRM2GRM3TSHR
SCHEMBL8764713 0.85 ALDH1A1 (0.33) GRM2GRM3ALDH1A1
SCHEMBL8891106 0.84 MAOA (0.30)
SCHEMBL8891904 0.83 GRM2 (0.36) GRM2GRM3ALDH1A1
SCHEMBL8892238 0.82 CCR8 (0.36) TSHRL3MBTL1
SCHEMBL8891210 0.82 EPHX1 (0.35) ALDH1A1TSHR

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-1997017950-A1 SHOULDER PROSTHESIS ELI LILLY AND COMPANY (US) 1997-05-22 WO disclosed