SCHEMBL21044949

SCHEMBL21044949

CCCCCCCCCCCCc1ccc(S(=O)(=O)Nc2ccc(F)c([Ti](C3=CC=CC3)C3=CC=CC3)c2F)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MOGAT2 Q3SYC2 6/20 0.44
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
AKT1 P31749 10/20 0.41
GAB1 Q13480 2/20 0.41
PDPK1 O15530 1/20 0.41
ABCB11 O95342 1/20 0.41
AKT2 P31751 1/20 0.41
AKT3 Q9Y243 1/20 0.41
KDM4E B2RXH2 1/20 0.39
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
HTR6 P50406 1/20 0.38

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
SCHEMBL21044952 0.80 FFAR1 (0.45) MOGAT2FFAR1FFAR4AKT1GAB1
SCHEMBL482873 0.79 FFAR1 (0.43) MOGAT2FFAR1FFAR4AKT1GAB1
SCHEMBL19970918 0.72 FFAR1 (0.45) MOGAT2FFAR1FFAR4AKT1GAB1
SCHEMBL27519143 0.68 FFAR1 (0.52) MOGAT2FFAR1FFAR4AKT1GAB1
SCHEMBL3027193 0.68 CYP3A4 (0.53) FFAR1FFAR4
SCHEMBL1814768 0.66 CYP2C9 (0.63) FFAR1FFAR4
SCHEMBL7151939 0.65 FFAR1 (0.78) FFAR1FFAR4AKT1GAB1PDPK1
SCHEMBL26965400 0.65 CA2 (0.64) FFAR1FFAR4AKT1GAB1PDPK1
SCHEMBL10926573 0.64 CA2 (0.62) FFAR1FFAR4AKT1GAB1PDPK1
SCHEMBL11891712 0.64 FFAR1 (0.66) FFAR1FFAR4AKT1GAB1PDPK1

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
EP-3492982-B1 PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, LAMINATE, METHOD FOR PRODUCING CURED FILM, METHOD FOR PRODUCING LAMINATE, AND SEMICONDUCTOR DEVICE FUJIFILM CORP (JP) 2020-11-11 EP disclosed
EP-3492982-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, LAMINATE, METHOD FOR PRODUCING CURED FILM, METHOD FOR PRODUCING LAMINATE, AND SEMICONDUCTOR DEVICE FUJIFILM Corporation (JP) 2019-06-05 EP disclosed