SCHEMBL7199891

SCHEMBL7199891

CCCCCCCCCCCCCCNC(=O)NNC(=O)COc1ccc(O)cc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.53
TSHR P16473 1/20 0.52
RECQL P46063 1/20 0.52
EPHX1 P07099 8/20 0.47
LTA4H P09960 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MGLL Q99685 2/20 0.46
ALDH1A1 P00352 2/20 0.46
NAAA Q02083 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL7197677 0.96 LTA4H (0.54) NR5A1TSHRRECQLEPHX1LTA4H
SCHEMBL7200734 0.92 KDM4E (0.55) NR5A1TSHRRECQLEPHX1LTA4H
SCHEMBL7197998 0.92 KDM4E (0.55) NR5A1TSHRRECQLEPHX1LTA4H
SCHEMBL7195903 0.90 TSHR (0.63) NR5A1TSHRRECQLKDM4EALDH1A1
SCHEMBL7195953 0.90 TSHR (0.63) NR5A1TSHRRECQLKDM4EALDH1A1
SCHEMBL7197616 0.88 LTA4H (0.54) NR5A1TSHRRECQLEPHX1LTA4H
SCHEMBL7197983 0.88 NR5A1 (0.56) NR5A1TSHRLTA4H
SCHEMBL7196598 0.88 TSHR (0.52) NR5A1TSHRRECQLEPHX1ALDH1A1
SCHEMBL7197909 0.88 LTA4H (0.54) NR5A1TSHRRECQLEPHX1LTA4H
SCHEMBL7201068 0.88 TSHR (0.52) NR5A1TSHRRECQLEPHX1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6596669-B1 Comprising a support and two reversible heat-sensitive recording layers having different colors formed on the same side of the support, comprising colorless electron-donative dye precursor and an electron-accepting compound MITSUBISHI PAPER MILLS LIMITED (JP) 2003-07-22 US disclosed
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