SCHEMBL9686453

SCHEMBL9686453

CCCCCCCCOC[CH]CCOCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.48
MEN1 O00255 1/20 0.48
THRB P10828 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 1/20 0.48
CES2 O00748 2/20 0.41
LSS P48449 1/20 0.41
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
USP2 O75604 1/20 0.38
CES1 P23141 1/20 0.37

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
SCHEMBL9470825 1.00 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL9470622 1.00 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL9470652 1.00 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL9470877 1.00 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL10630735 0.98 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL19512083 0.89 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL11877091 0.89 MEN1 (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL9122943 0.89 MEN1 (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL8378690 0.89 MEN1 (0.45) HTTMEN1THRBKMT2AMAPT
SCHEMBL8379544 0.89 MEN1 (0.45) HTTMEN1THRBKMT2AMAPT

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-0506615-A2 Stabilized methylmethacrylate polymers CIBA-GEIGY AG (CH) 1992-09-30 EP disclosed