SCHEMBL30765124

SCHEMBL30765124

CC(=O)c1c(F)ccc(F)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
KMT2A Q03164 5/20 0.39
MEN1 O00255 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.39
THRB P10828 1/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
PKM P14618 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
P2RX7 Q99572 1/20 0.35
ALDH2 P05091 1/20 0.35
GAA P10253 3/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL5805576 1.00 CES2 (0.39) CES2CES1KMT2AMEN1SMN1; SMN2
SCHEMBL3101770 0.87 NOTUM (0.37) CES2CES1KMT2AMEN1SMN1; SMN2
SCHEMBL488779 0.87 DPP4 (0.38) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL30553986 0.87 DPP4 (0.38) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL30313251 0.85 KMT2A (0.40) CES2CES1KMT2AMEN1SMN1; SMN2
SCHEMBL714300 0.85 KMT2A (0.40) CES2CES1KMT2AMEN1SMN1; SMN2
SCHEMBL8262561 0.81 RAB9A (0.42) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL3113530 0.80 CES2 (0.38) CES2CES1KMT2AMEN1SMN1; SMN2
SCHEMBL2334297 0.79 DPP4 (0.41) CES2CES1SMN1; SMN2P2RX7ALDH2
SCHEMBL1165021 0.79 ALDH1A1 (0.44) CES2CES1P2RX7ALDH2GAA

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-112424181-B Substituted condensed thiophenes as STING modulators 希泰克斯特私人有限公司 2024-02-27 CN disclosed