SCHEMBL8307911

SCHEMBL8307911

CC(=O)N[C@@H](CSC(=O)c1ccc(F)cc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ ACE P12821 1/20 0.43
▸ FOLH1 Q04609 5/20 0.42
▸ PAM P19021 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ THPO P40225 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ CA2 P00918 1/20 0.39
▸ GPR139 Q6DWJ6 1/20 0.39
▸ PRNP P04156 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL8307913 1.00 TSHR (0.54) TSHRKMT2AACEFOLH1PAM
SCHEMBL16641857 0.87 ALDH1A1 (0.46) TSHRKMT2AACEPAMKDM4E
SCHEMBL16641859 0.87 ALDH1A1 (0.46) TSHRKMT2AACEPAMKDM4E
SCHEMBL8310917 0.87 GPR139 (0.51) KMT2APAMKDM4EMAPTTHRB
SCHEMBL8310911 0.87 GPR139 (0.51) KMT2APAMKDM4EMAPTTHRB
SCHEMBL8310589 0.85 PPARG (0.49) TSHRACEPAMSMN1; SMN2CTSL
SCHEMBL8310591 0.85 PPARG (0.49) TSHRACEPAMSMN1; SMN2CTSL
SCHEMBL8308373 0.83 PPARG (0.48) KMT2AACEMAPTCA2
SCHEMBL8308366 0.83 PPARG (0.48) KMT2AACEMAPTCA2
SCHEMBL10363718 0.82 PAM (0.52) KMT2APAMKDM4EMAPTTHRB

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-0903346-A1 SYDNONE IMINE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 1999-03-24 — — EP disclosed
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