SCHEMBL10705134

SCHEMBL10705134

C=C(C)C(=O)OC1CCCCC1.C=CC(=O)OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
HCAR2 Q8TDS4 1/20 0.41
FKBP1A P62942 2/20 0.41
SGMS2 Q8NHU3 1/20 0.40
LMNA P02545 1/20 0.39
CTSB P07858 2/20 0.39
CTSS P25774 2/20 0.39
CTSK P43235 2/20 0.39
CTSL P07711 1/20 0.39
EPHX1 P07099 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL7116762 0.89 ALDH1A1 (0.46) ALDH1A1FKBP1ASGMS2CTSBCTSS
SCHEMBL8437441 0.88 HCAR2 (0.47) ALDH1A1HCAR2SGMS2LMNAEPHX1
Methacrylic Acid SCHEMBL22607673 0.87 ALDH1A1 (0.44) ALDH1A1FKBP1ASGMS2CTSBCTSS
SCHEMBL11287908 0.85 FKBP1A (0.50) ALDH1A1FKBP1ASGMS2CTSBCTSS
SCHEMBL28107692 0.83 ELANE (0.42) ALDH1A1
SCHEMBL4170802 0.82 ALDH1A1 (0.53) ALDH1A1HCAR2LMNAKMT2A
SCHEMBL31053740 0.81 FKBP1A (0.39) ALDH1A1HCAR2FKBP1ALMNACTSB
SCHEMBL1489587 0.81 HCAR2 (0.50) ALDH1A1HCAR2LMNAKMT2ATSHR
Methacrylic Acid SCHEMBL11963174 0.80 TSHR (0.45) ALDH1A1FKBP1ACTSBCTSSCTSK
SCHEMBL628109 0.80 ALDH1A1 (0.50) ALDH1A1HCAR2FKBP1ALMNAMEN1

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
CN-104334639-B For the resin combination of laser direct forming, synthetic resin and the manufacture method having coated products formed 三菱工程塑料株式会社 2016-06-22 CN disclosed
EP-0136246-B1 MULTILAYER AUTOMOTIVE PAINT SYSTEM BASF Corporation (US) 1988-08-10 EP disclosed
EP-0080539-A1 Polymers primarily for contact lenses, and contact lenses made from them Tsuetaki, George F. (US) 1983-06-08 EP disclosed
WO-1983001777-A1 IMPROVED OXYGEN PERMEABLE HARD AND SEMI-HARD CONTACT LENS COMPOSITIONS, METHODS AND ARTICLES OF MANUFACTURE TSUETAKI GEORGE F (US) 1983-05-26 WO disclosed