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SCHEMBL8994930

SCHEMBL8994930

COc1ccc(C(=O)N=C(N)c2ccc(OCCCCCOc3ccc(C(=O)N(C(C)C)C(C)C)cc3OC)cc2)cc1OC

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 3/20 0.75
▸ LTB4R2 Q9NPC1 1/20 0.68
▸ PRSS1 P07477 4/20 0.46
▸ PLA2G4B P0C869 1/20 0.45
▸ MAPT P10636 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAOB P27338 2/20 0.42
▸ THRA P10827 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ REN P00797 1/20 0.41
▸ KMT2A Q03164 1/20 0.40
▸ SMPD1 P17405 1/20 0.40

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
SCHEMBL8994891 0.92 LTB4R (0.75) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL8994880 0.91 LTB4R (0.74) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL8994895 0.90 LTB4R (0.72) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL8994902 0.90 LTB4R (0.72) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL8747956 0.90 LTB4R (0.78) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL8747955 0.90 LTB4R (0.78) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL8748238 0.90 LTB4R (0.78) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL8748241 0.90 LTB4R (0.78) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL9141737 0.90 LTB4R (0.71) LTB4RLTB4R2PRSS1PLA2G4BMAPT
SCHEMBL8995045 0.90 LTB4R (0.71) LTB4RLTB4R2PRSS1PLA2G4BMAPT

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
US-5488160-A LEUKOTRIENE B4 RECEPTOR ANTAGONIST AS ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1996-01-30 — — US disclosed