SCHEMBL8587735

SCHEMBL8587735

CCCCCCCCCCCCCCCCCC(=O)NCCN1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.62
ALDH1A1 P00352 2/20 0.57
FAAH O00519 4/20 0.54
DNM1 Q05193 2/20 0.51
CASP2 P42575 1/20 0.50
MAPT P10636 1/20 0.50
PLD1 Q13393 2/20 0.49
OPRD1 P41143 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
NPC1 O15118 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 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
SCHEMBL9633481 1.00 KDM4E (0.62) KDM4EALDH1A1FAAHDNM1CASP2
SCHEMBL21998740 1.00 KDM4E (0.62) KDM4EALDH1A1FAAHDNM1CASP2
SCHEMBL21998662 1.00 KDM4E (0.62) KDM4EALDH1A1FAAHDNM1CASP2
SCHEMBL21998674 1.00 KDM4E (0.62) KDM4EALDH1A1FAAHDNM1CASP2
SCHEMBL21998915 0.98 KDM4E (0.59) KDM4EALDH1A1FAAHDNM1CASP2
SCHEMBL21998652 0.98 KDM4E (0.59) KDM4EALDH1A1FAAHDNM1CASP2
SCHEMBL21998654 0.98 KDM4E (0.59) KDM4EALDH1A1FAAHDNM1CASP2
SCHEMBL20900504 0.97 KDM4E (0.57) KDM4EALDH1A1FAAHDNM1CASP2
SCHEMBL13661579 0.94 ALDH1A1 (0.64) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL13462681 0.92 ALDH1A1 (0.61) KDM4EALDH1A1FAAHCASP2MAPT

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-5817599-A COLORLESS DYE PRECURSOR AND REVERSIBLE COLOR DEVELOPER MITSUBISHI PAPER MILLS LIMITED (JP) 1998-10-06 US disclosed