SCHEMBL6754441

SCHEMBL6754441

NC(=O)Cc1cccc(OCCCOc2cccc(CC(N)=O)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NR1H3 Q13133 7/20 0.53
▸ PRSS1 P07477 4/20 0.51
▸ PLA2G4B P0C869 1/20 0.49
▸ F2 P00734 1/20 0.47
▸ PLG P00747 1/20 0.47
▸ PRSS2 P07478 1/20 0.47
▸ C1S P09871 1/20 0.47
▸ PRSS3 P35030 1/20 0.47
▸ PLA2G2A P14555 1/20 0.47

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
SCHEMBL11209971 0.91 PLA2G4B (0.61) NR1H3PLA2G4B
SCHEMBL6631625 0.90 NR1H3 (0.48) NR1H3PLA2G4BPLA2G2A
SCHEMBL18137261 0.90 GLS (0.50) NR1H3PLA2G4B
SCHEMBL31570778 0.89 NR1H3 (0.47) NR1H3PLA2G4BPLA2G2A
SCHEMBL20379485 0.89 NR1H3 (0.48) NR1H3PLA2G4BPLA2G2A
SCHEMBL4010528 0.85 TP53 (0.51) NR1H3
SCHEMBL29658673 0.85 NR1H3 (0.50) NR1H3PLA2G4BPLA2G2A
SCHEMBL25081989 0.84 PLA2G4B (0.64) NR1H3PLA2G4B
SCHEMBL30278807 0.84 PLA2G4B (0.64) NR1H3PLA2G4B
SCHEMBL2848980 0.83 NR4A2 (0.62) —

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6787502-B2 INCLUSION OF A STRONGLY BASIC BIS-GUANIDINE COMPOUND THAT IS SUPERIOR IN DIFFUSION RESISTANCE; SPECIFIED DIAZONIUM SALT COMPOUND AND A PYRROLO(1,2-A)PYRIMIDINE COUPLER IN RECORDING LAYER FUJI PHOTO FILM CO., LTD. (JP) 2004-09-07 — — US disclosed
US-20030158038-A1 Guanidine compound and heat sensitive recording material FUJI PHOTO FILM CO., LTD. 2003-08-21 — — US disclosed
US-20020065194-A1 Guanidine compound and heat sensitive recording material FUJI PHOTO FILM CO., LTD. 2002-05-30 — — US disclosed
US-6348529-B1 THERMOSENSITIVE RECORDING WITH TWO ETHERS AND TWO GUANIDINE GROUPS FUJI PHOTO FILM CO., LTD. (JP) 2002-02-19 — — US disclosed
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