SCHEMBL25340452

SCHEMBL25340452

CP(C)(=O)c1ccc(-c2cccnc2Sc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 3/20 0.38
▸ KLRK1 P26718 1/20 0.38
▸ MICA Q29983 1/20 0.38
▸ RAET1L Q5VY80 1/20 0.38
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ GRM5 P41594 1/20 0.36
▸ TRPV1 Q8NER1 6/20 0.36
▸ FFAR4 Q5NUL3 2/20 0.36
▸ KIF11 P52732 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ TLR7 Q9NYK1 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34

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
SCHEMBL25340771 0.88 SLC6A2 (0.38) TOP1KLRK1MICARAET1LSLC6A2
SCHEMBL25341313 0.85 TOP1 (0.36) TOP1KLRK1MICARAET1LSLC6A2
SCHEMBL25341521 0.77 FFAR4 (0.38) TOP1KLRK1MICARAET1LGRM5
SCHEMBL25374988 0.77 ADORA2A (0.44) TOP1GRM5KIF11SMN1; SMN2ALDH1A1
SCHEMBL25975846 0.75 TOP1 (0.38) TOP1KLRK1MICARAET1LSLC6A2
SCHEMBL25379007 0.75 GPBAR1 (0.44) SMN1; SMN2
SCHEMBL25376949 0.75 GRM5 (0.39) TOP1SLC6A2SLC6A4GRM5TRPV1
SCHEMBL25379729 0.75 GRM5 (0.37) TOP1SLC6A2SLC6A4GRM5SMN1; SMN2
SCHEMBL25428400 0.74 PTGIR (0.36) TOP1KLRK1MICARAET1LGRM5
SCHEMBL20394412 0.74 GPBAR1 (0.43) GRM5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023146513-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
WO-2023146513-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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