SCHEMBL30934638

SCHEMBL30934638

CC(=O)Nc1c[nH]c2ccc(Cc3ccc(C(F)(F)F)cc3)cc12

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SNCA P37840 4/20 0.48
STING1 Q86WV6 1/20 0.48
CYP2C9 P11712 2/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
IDO1 P14902 1/20 0.43
TDO2 P48775 1/20 0.43
KIF11 P52732 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
GABRA1 P14867 3/20 0.41
GABRB2 P47870 3/20 0.41
TRPV1 Q8NER1 1/20 0.41
TOP2A P11388 1/20 0.40
GABRB1 P18505 1/20 0.39
GABRA3 P34903 1/20 0.39
SRD5A2 P31213 1/20 0.39
CHRNA7 P36544 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
SCHEMBL25025764 1.00 SNCA (0.48) SNCASTING1CYP2C9LMNAHPGD
SCHEMBL25025556 0.88 STING1 (0.46) SNCASTING1CYP2C9IDO1TDO2
SCHEMBL30233599 0.87 STING1 (0.46) SNCASTING1CYP2C9LMNAIDO1
SCHEMBL25025629 0.87 STING1 (0.46) SNCASTING1CYP2C9LMNAIDO1
SCHEMBL25025720 0.87 STING1 (0.46) SNCASTING1CYP2C9LMNAIDO1
SCHEMBL25025585 0.86 STING1 (0.47) SNCASTING1CYP2C9LMNAIDO1
SCHEMBL25026130 0.85 MAOB (0.51) STING1CYP2C9CYP1A2CYP2C19TRPV1
SCHEMBL25025752 0.85 STING1 (0.47) SNCASTING1CYP2C9LMNAIDO1
SCHEMBL25554406 0.85 LMNA (0.52) SNCASTING1CYP2C9LMNAHPGD
SCHEMBL25025753 0.85 STING1 (0.46) SNCASTING1CYP2C9LMNAIDO1

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
CN-118119595-A Compounds and compositions for the treatment of diseases associated with STING activity 艾福姆德尤股份有限公司 2024-05-31 CN disclosed