SCHEMBL30968704

SCHEMBL30968704

CCCCCCCCCCCCCCc1[nH]c(=O)[nH]c(=O)c1F

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TYMP P19971 6/20 0.51
GPR84 Q9NQS5 8/20 0.45
HCAR2 Q8TDS4 3/20 0.42
GHSR Q92847 1/20 0.36

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
SCHEMBL10885266 0.72 GPR84 (0.44) TYMPGPR84HCAR2
SCHEMBL10964068 0.72 GPR84 (0.44) TYMPGPR84HCAR2
SCHEMBL10885262 0.69 GPR84 (0.42) TYMPGPR84HCAR2
SCHEMBL14524977 0.67 TYMP (0.48) TYMPGPR84HCAR2
SCHEMBL5270384 0.64 TYMP (0.43) TYMPGPR84
SCHEMBL891089 0.63 TYMP (0.46) TYMPGPR84
SCHEMBL14709896 0.63 TYMP (0.47) TYMPHCAR2
SCHEMBL2360239 0.62 TYMP (0.44) TYMPGPR84
SCHEMBL10197626 0.62 GPR84 (0.38) TYMPGPR84
SCHEMBL648709 0.62 TYMP (0.67) TYMPHCAR2

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-115300514-B Double-response drug controlled release system with double-drug sequential delivery function and preparation method and application thereof 常州大学 2024-05-24 CN disclosed