SCHEMBL9007953

SCHEMBL9007953

CCOCCOCCCCCCC[C]=O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
EPHX2 P34913 4/20 0.37
TSHR P16473 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 1/20 0.33
CES2 O00748 1/20 0.32
USP2 O75604 1/20 0.31
NPC1 O15118 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL11614271 0.96 ALDH1A1 (0.35) THRBMEN1HTTKMT2AMAPT
SCHEMBL8576827 0.96 ALDH1A1 (0.35) THRBMEN1HTTKMT2AMAPT
SCHEMBL4912343 0.93
SCHEMBL5255816 0.86
SCHEMBL4911943 0.84 HTT (0.40) THRBMEN1HTTKMT2AMAPT
SCHEMBL5252568 0.84 HTT (0.40) THRBMEN1HTTKMT2AMAPT
SCHEMBL8582259 0.84 HTT (0.50) THRBMEN1HTTKMT2AMAPT
SCHEMBL12924146 0.81 THRB (0.52) THRBMEN1HTTKMT2AMAPT
SCHEMBL12924144 0.81 THRB (0.52) THRBMEN1HTTKMT2AMAPT
SCHEMBL1714936 0.80 EPHX2 (0.37) THRBKMT2AMAPTEPHX2TSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5571689-A Method of N-acylating peptide and proteins with diheteroatom substituted analogs of myristic acid WASHINGTON UNIVERSITY (US) 1996-11-05 US disclosed
EP-0441765-B1 Novel fatty acid analog enzyme substrates UNIV WASHINGTON (US) 1994-05-11 EP disclosed
US-5082967-A Myristolyation WASHINGTON UNIVERSITY (US) 1992-01-21 US disclosed
EP-0441765-A1 Novel fatty acid analog enzyme substrates WASHINGTON UNIVERSITY (US) 1991-08-14 EP disclosed