SCHEMBL7196973

SCHEMBL7196973

CCCCCCCCCCCCCCNC(=O)C(=O)NCCOc1ccc(Oc2ccc(O)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 5/20 0.64
NR5A1 Q13285 1/20 0.59
ESR1 P03372 7/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL7200841 0.99 LTA4H (0.66) LTA4HNR5A1ESR1TP53TSHR
SCHEMBL7201045 0.96 LTA4H (0.70) LTA4HNR5A1ESR1TP53TSHR
SCHEMBL7749223 0.96 NR5A1 (0.64) LTA4HNR5A1ESR1MEN1KMT2A
SCHEMBL7199892 0.95 NR5A1 (0.66) LTA4HNR5A1ESR1TP53TSHR
SCHEMBL7198378 0.92 LTA4H (0.64) LTA4HNR5A1ESR1MEN1KMT2A
SCHEMBL7193302 0.92 LTA4H (0.64) LTA4HNR5A1ESR1MEN1KMT2A
SCHEMBL7197076 0.92 NR5A1 (0.71) LTA4HNR5A1ESR1TP53TSHR
SCHEMBL7196651 0.91 LTA4H (0.62) LTA4HNR5A1ESR1TSHR
SCHEMBL7198036 0.89 TRPV1 (0.53) LTA4HNR5A1MEN1KMT2A
SCHEMBL7194096 0.88 LTA4H (0.70) LTA4HNR5A1TP53TSHR

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-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