SCHEMBL7749223

SCHEMBL7749223

CCCCCCCCCCCCCCNC(=O)C(=O)NCCOc1ccc(O)cc1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.64
LTA4H P09960 2/20 0.56
ESR1 P03372 8/20 0.51
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 1/20 0.49
PLA2G4B P0C869 1/20 0.49

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
SCHEMBL7199892 0.99 NR5A1 (0.66) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7196973 0.96 LTA4H (0.64) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7197076 0.96 NR5A1 (0.71) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7200841 0.94 LTA4H (0.66) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7201045 0.92 LTA4H (0.70) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7750795 0.92 NR5A1 (0.65) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL7201659 0.91 NR5A1 (0.64) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7199768 0.91 NR5A1 (0.64) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7195800 0.90 NR5A1 (0.62) NR5A1LTA4HESR1TSHR
SCHEMBL7749284 0.88 NR5A1 (0.60) NR5A1LTA4HTP53TSHRPLA2G4B

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