SCHEMBL31377019

SCHEMBL31377019

CCc1ccc(/C=C2\SC(=O)N(CCCC(=O)Nc3ccc(C(=O)O)c(NC(C)=O)c3)C2=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.62
▸ MITF O75030 1/20 0.61
▸ PTPN12 Q05209 6/20 0.61
▸ GPR35 Q9HC97 6/20 0.61
▸ PTPN22 Q9Y2R2 6/20 0.61
▸ PTPN7 P35236 5/20 0.61
▸ TDP1 Q9NUW8 4/20 0.61
▸ GPR55 Q9Y2T6 3/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ NPC1 O15118 2/20 0.57
▸ MYC P01106 1/20 0.56
▸ KMT2A Q03164 8/20 0.54
▸ MEN1 O00255 6/20 0.54
▸ PSMD14 O00487 2/20 0.54
▸ BLM P54132 1/20 0.54
▸ SAE1 Q9UBE0 1/20 0.54
▸ UBA2 Q9UBT2 1/20 0.54
▸ CTDSP1 Q9GZU7 1/20 0.51
▸ KDR P35968 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.49

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
SCHEMBL31377024 0.92 MITF (0.64) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31376928 0.91 POLB (0.64) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31377037 0.90 POLB (0.59) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31376962 0.89 GPR35 (0.66) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31376994 0.89 NPC1 (0.65) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31377033 0.89 NPC1 (0.72) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31376947 0.88 GPR35 (0.63) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31376972 0.88 GPR35 (0.63) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31377011 0.88 GPR35 (0.65) POLBMITFPTPN12GPR35PTPN22
SCHEMBL31377003 0.87 GPR35 (0.64) POLBMITFPTPN12GPR35PTPN22

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
WO-2025064325-A1 GPR35 MODULATORS PROMETHEUS BIOSCIENCES, INC. (US) 2025-03-27 — — WO disclosed
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