SCHEMBL8768753

SCHEMBL8768753

CCCCCC(C)CCCCCCCCCCOC(NCCO)C(C)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.37
HTT P42858 2/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 1/20 0.34
USP2 O75604 1/20 0.34
PRKD3 O94806 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCH P24723 1/20 0.34
PRKCI P41743 1/20 0.34
PRKCE Q02156 1/20 0.34
PRKCQ Q04759 1/20 0.34
PRKCZ Q05513 1/20 0.34
PRKCD Q05655 1/20 0.34
PRKD1 Q15139 1/20 0.34
FAAH O00519 3/20 0.33
SPHK1 Q9NYA1 2/20 0.33

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
SCHEMBL8768723 1.00 ACE2 (0.37) ACE2HTTMAPTMEN1THRB
SCHEMBL9361500 0.93 MEN1 (0.39) HTTMAPTMEN1THRBKMT2A
SCHEMBL28782029 0.93 MEN1 (0.39) HTTMAPTMEN1THRBKMT2A
SCHEMBL8781176 0.91 FFAR4 (0.37) HTTMAPTMEN1THRBKMT2A
SCHEMBL27728790 0.85 CNR1 (0.33)
SCHEMBL9427113 0.75 MEN1 (0.42) HTTMAPTMEN1THRBKMT2A
SCHEMBL9814222 0.73 DNM1 (0.41) HTTMAPTMEN1THRBKMT2A
SCHEMBL21963320 0.72 DNM1 (0.40) HTTMEN1KMT2AUSP2FAAH
SCHEMBL1551339 0.72 DNM1 (0.40) HTTMEN1KMT2AUSP2FAAH
SCHEMBL9801552 0.70 LMNA (0.50) HTTMAPTMEN1KMT2AFAAH

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
EP-0790977-A1 AMINE DERIVATIVES FOR TREATMENT OF SKIN DISORDERS Kao Corporation (JP) 1997-08-27 EP disclosed