SCHEMBL7743731

SCHEMBL7743731

CCCCCCCCCCCCC(C)OCCNC(=O)NNCCOc1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.48
LTA4H P09960 2/20 0.43
ABCG2 Q9UNQ0 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ESR1 P03372 7/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
PPARG P37231 2/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL7749291 1.00 NR5A1 (0.48) NR5A1LTA4HABCG2MEN1KMT2A
SCHEMBL7743717 0.93 NR5A1 (0.52) NR5A1LTA4HABCG2MEN1KMT2A
SCHEMBL7743736 0.93 NR5A1 (0.52) NR5A1LTA4HABCG2MEN1KMT2A
SCHEMBL7743820 0.89 NR5A1 (0.53) NR5A1LTA4HABCG2TP53TSHR
SCHEMBL7749113 0.88 NR5A1 (0.51) NR5A1LTA4HABCG2MEN1KMT2A
SCHEMBL7750954 0.88 NR5A1 (0.46) NR5A1LTA4HABCG2
SCHEMBL7748401 0.86 NR5A1 (0.47) NR5A1LTA4HABCG2TP53TSHR
SCHEMBL7199898 0.85 NR5A1 (0.59) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7195035 0.85 NR5A1 (0.59) NR5A1LTA4HESR1TP53TSHR
SCHEMBL7192704 0.85 NR5A1 (0.59) NR5A1LTA4HMEN1KMT2AESR1

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