SCHEMBL31377024

SCHEMBL31377024

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

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MITF O75030 1/20 0.64
▸ POLB P06746 3/20 0.60
▸ TDP1 Q9NUW8 5/20 0.59
▸ PTPN12 Q05209 3/20 0.59
▸ GPR35 Q9HC97 3/20 0.59
▸ PTPN22 Q9Y2R2 3/20 0.59
▸ PTPN7 P35236 2/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ GPR55 Q9Y2T6 1/20 0.59
▸ NPC1 O15118 2/20 0.56
▸ PSMD14 O00487 2/20 0.54
▸ KMT2A Q03164 6/20 0.53
▸ MEN1 O00255 5/20 0.53
▸ BLM P54132 1/20 0.53
▸ SAE1 Q9UBE0 1/20 0.53
▸ UBA2 Q9UBT2 1/20 0.53
▸ MYC P01106 1/20 0.51
▸ NPSR1 Q6W5P4 3/20 0.50
▸ TNNI3 P19429 1/20 0.50
▸ TNNT2 P45379 1/20 0.50

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
SCHEMBL31377019 0.92 POLB (0.62) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31376928 0.90 POLB (0.64) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31377037 0.88 POLB (0.59) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31376962 0.88 GPR35 (0.66) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31376994 0.88 NPC1 (0.65) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31377033 0.88 NPC1 (0.72) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31376972 0.87 GPR35 (0.63) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31376947 0.87 GPR35 (0.63) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31377011 0.87 GPR35 (0.65) MITFPOLBTDP1PTPN12GPR35
SCHEMBL31377003 0.86 GPR35 (0.64) MITFPOLBTDP1PTPN12GPR35

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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