SCHEMBL7743620

SCHEMBL7743620

CCCCCCCCCCCCCCCC(CC)SCCCNC(=O)NCCOc1ccc(O)c(O)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.45
CNR2 P34972 3/20 0.41
CNR1 P21554 2/20 0.41
TRPV1 Q8NER1 1/20 0.40
CPT2 P23786 1/20 0.38
CPT1A P50416 1/20 0.38
CPT1B Q92523 1/20 0.38
NAAA Q02083 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL7195031 0.85 ADRB2 (0.53) ADRB2CNR2CNR1TRPV1NAAA
SCHEMBL7750960 0.85 NR5A1 (0.48) MEN1KMT2A
SCHEMBL7750917 0.84 NR5A1 (0.47) CNR2CNR1MEN1KMT2A
SCHEMBL7747948 0.84 CNR2 (0.47) ADRB2CNR2CNR1TRPV1CPT2
SCHEMBL7750784 0.81 NR5A1 (0.42) CNR2CNR1
SCHEMBL7749255 0.80 NR5A1 (0.43) CNR2CNR1MEN1KMT2A
SCHEMBL7749301 0.80 CNR2 (0.45) CNR2CNR1
SCHEMBL7750898 0.80 NR5A1 (0.45) CNR2CNR1
SCHEMBL7750800 0.79 KDM4E (0.44) ADRB2MEN1KMT2A
SCHEMBL7750826 0.79 ADRB2 (0.48) ADRB2CNR2CNR1TRPV1NAAA

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