SCHEMBL7197908

SCHEMBL7197908

CCCCCCCCCCCCCCCCCCNC(=O)C(=O)Nc1ccc(Oc2ccc(Oc3ccc(O)cc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 1/20 0.50
ALDH1A1 P00352 2/20 0.49
GAA P10253 2/20 0.49
MAPT P10636 2/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
LTA4H P09960 2/20 0.49
GLA P06280 1/20 0.48
ALOX12 P18054 1/20 0.48
EPHX1 P07099 4/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
PSMB11 A5LHX3 2/20 0.46
PSMA7 O14818 2/20 0.46
PSMB1 P20618 2/20 0.46
PSMA1 P25786 2/20 0.46
PSMA2 P25787 2/20 0.46
PSMA3 P25788 2/20 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
SCHEMBL7197799 1.00 HTT (0.51) HTTSMN1; SMN2LMNAALDH1A1GAA
SCHEMBL8623606 0.92 EPHX1 (0.55) HTTSMN1; SMN2LMNAALDH1A1GAA
SCHEMBL8624191 0.92 EPHX1 (0.55) HTTSMN1; SMN2LMNAALDH1A1GAA
SCHEMBL8627419 0.92 EPHX1 (0.55) HTTSMN1; SMN2LMNAALDH1A1GAA
SCHEMBL7198019 0.88 EPHX1 (0.63) HTTALDH1A1MAPTKMT2ALTA4H
SCHEMBL7197441 0.88 EPHX1 (0.63) HTTALDH1A1MAPTKMT2ALTA4H
SCHEMBL7197119 0.88 EPHX1 (0.51) HTTSMN1; SMN2LMNAALDH1A1GAA
SCHEMBL7197888 0.86 PSMB11 (0.54) HTTALDH1A1GAAMAPTKMT2A
SCHEMBL7199964 0.86 PSMB11 (0.54) HTTALDH1A1GAAMAPTKMT2A
SCHEMBL7201045 0.85 LTA4H (0.70) HTTSMN1; SMN2LTA4H

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