SCHEMBL31376975

SCHEMBL31376975

CCc1ccc(/C=C2\SC(=O)N(CCCC(=O)Nc3nc(C(=O)O)co3)C2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 4/20 0.57
▸ RAB9A P51151 2/20 0.57
▸ PTPN7 P35236 1/20 0.57
▸ PTPN12 Q05209 1/20 0.57
▸ GPR35 Q9HC97 1/20 0.57
▸ PTPN22 Q9Y2R2 1/20 0.57
▸ GPR55 Q9Y2T6 1/20 0.57
▸ POLB P06746 5/20 0.55
▸ MYC P01106 3/20 0.54
▸ KMT2A Q03164 8/20 0.53
▸ MEN1 O00255 7/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ HTT P42858 1/20 0.53
▸ PSMD14 O00487 1/20 0.50
▸ BLM P54132 1/20 0.50
▸ SAE1 Q9UBE0 1/20 0.50
▸ UBA2 Q9UBT2 1/20 0.50
▸ MITF O75030 2/20 0.49
▸ KDR P35968 1/20 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
SCHEMBL31376948 0.84 GPR35 (0.64) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31376970 0.81 TDP1 (0.83) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31376983 0.79 ALDH1A1 (0.60) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31376923 0.79 MYC (0.68) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31377010 0.78 KMT2A (0.75) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31377011 0.78 GPR35 (0.65) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31376962 0.78 GPR35 (0.66) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31377033 0.78 NPC1 (0.72) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31376994 0.78 NPC1 (0.65) TDP1RAB9APTPN7PTPN12GPR35
SCHEMBL31377003 0.78 GPR35 (0.64) TDP1RAB9APTPN7PTPN12GPR35

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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