SCHEMBL874417

SCHEMBL874417

CCCCCCCCCCCCCCCOCCOC(CCCC)CCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
DNM1 Q05193 2/20 0.47
LPAR1 Q92633 5/20 0.44
LPAR3 Q9UBY5 5/20 0.44
LPAR2 Q9HBW0 2/20 0.44
USP2 O75604 1/20 0.40
PLA2G2C Q5R387 1/20 0.40
TLR2 O60603 3/20 0.40
PRKD3 O94806 1/20 0.39
PRKCG P05129 1/20 0.39
PRKCB P05771 1/20 0.39
PRKCA P17252 1/20 0.39
PRKCH P24723 1/20 0.39
PRKCI P41743 1/20 0.39
PRKCE Q02156 1/20 0.39
PRKCQ Q04759 1/20 0.39

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
SCHEMBL1478563 0.98 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL3483124 0.94 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL19131086 0.94 DNM1 (0.53) HTTMEN1THRBKMT2AMAPT
SCHEMBL3482684 0.90 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL6009964 0.90 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL25832843 0.89 CYP3A4 (0.40) HTTMEN1THRBKMT2AMAPT
SCHEMBL11182917 0.87 DNM1 (0.59) DNM1LPAR1LPAR3LPAR2TLR2
SCHEMBL11179946 0.87 DNM1 (0.59) DNM1LPAR1LPAR3LPAR2TLR2
SCHEMBL31064986 0.87 DNM1 (0.59) DNM1LPAR1LPAR3LPAR2TLR2
SCHEMBL11674787 0.87 DNM1 (0.59) DNM1LPAR1LPAR3LPAR2TLR2

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-20120073591-A1 METHOD OF CLEANSING KAO CORPORATION (JP) 2012-03-29 US disclosed