SCHEMBL7749301

SCHEMBL7749301

CCCCCCCC(CC)SCCCNC(=O)NCNC(=O)CCCCCCCCCCOc1ccc(O)cc1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.45
CNR1 P21554 10/20 0.45
NR5A1 Q13285 1/20 0.44
LTA4H P09960 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
SCHEMBL7750784 0.95 NR5A1 (0.42) CNR2CNR1NR5A1LTA4H
SCHEMBL7750807 0.93 CNR2 (0.52) CNR2CNR1NR5A1
SCHEMBL7750898 0.91 NR5A1 (0.45) CNR2CNR1NR5A1LTA4H
SCHEMBL7196701 0.86 NR5A1 (0.56) CNR2CNR1NR5A1LTA4H
SCHEMBL7749255 0.86 NR5A1 (0.43) CNR2CNR1NR5A1LTA4H
SCHEMBL7749116 0.85 NR5A1 (0.46) CNR2CNR1NR5A1LTA4H
SCHEMBL7748378 0.84 CNR2 (0.45) CNR2CNR1NR5A1LTA4H
SCHEMBL7750917 0.84 NR5A1 (0.47) CNR2CNR1NR5A1LTA4H
SCHEMBL7201663 0.83 LTA4H (0.56) CNR2CNR1NR5A1LTA4H
SCHEMBL7193376 0.83 NR5A1 (0.54) CNR2CNR1NR5A1LTA4H

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-6184180-B1 COMPRISES SUPPORT, REVERSIBLE HEAT-SENSITIVE RECORDING LAYER CONTAINING DYE PRECURSOR WHICH IS COLORLESS OR A PALE COLOR, COLOR DEVELOPER CAPABLE OF CAUSING REVERSIBLE CHANGE IN COLOR DENSITY OF DYE DUE TO DIFFERENCE IN COOLING RATE MITSUBISHI PAPER MILLS LIMITED (JP) 2001-02-06 US disclosed