SCHEMBL6254118

SCHEMBL6254118

O=C1[N]C(=O)C12CC1C=CC2C1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
P2RX7 Q99572 1/20 0.31

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
SCHEMBL17503523 0.82 CYP2D6 (0.36) CYP2D6CYP2C19
SCHEMBL446851 0.82 CYP2D6 (0.36) CYP2D6CYP2C19
SCHEMBL5861860 0.76 CYP2D6 (0.35) CYP2D6CYP2C19
SCHEMBL9705137 0.73 CYP2D6 (0.37) CYP2D6CYP2C19
SCHEMBL5322625 0.73 ALDH1A1 (0.33) CYP2D6CYP2C19
SCHEMBL18107021 0.71 CYP2D6 (0.33) CYP2D6CYP2C19
Trifluoromethanesulfonic Acid SCHEMBL448452 0.69
SCHEMBL16034793 0.67
SCHEMBL7921355 0.67 ELANE (0.40)
SCHEMBL651196 0.65 ESR2 (0.35) CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1052113-B1 Heat-sensitive imaging element for providing a lithographic printing plate FUJI PHOTO FILM CO LTD (JP) 2005-09-14 EP disclosed
US-6534237-B1 Hydrophilic layer having cross-linked structure of a metal colloid-containing cross-linked polymer or a condensate of an organic hydrophilic polymer and a silane coupling agent, and a layer with a polymer that changes solubility with heat FUJI PHOTO FILM CO., LTD. (JP) 2003-03-18 US disclosed
EP-1052113-A1 Heat-sensitive imaging element for providing a lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 2000-11-15 EP disclosed