SCHEMBL7948426

SCHEMBL7948426

CCCCCCOC(=O)C(=CC=C(C)C(=O)O)CC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
NAAA Q02083 1/20 0.46
HCAR2 Q8TDS4 2/20 0.44
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EPHX1 P07099 1/20 0.40
FAAH O00519 2/20 0.40
ALDH1A1 P00352 2/20 0.38
CES2 O00748 1/20 0.38
LMNA P02545 1/20 0.36
ATM Q13315 1/20 0.36
ACHE P22303 4/20 0.36

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
SCHEMBL7915800 0.96 TSHR (0.46) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL4341564 0.89 TSHR (0.50) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL28075392 0.87 TSHR (0.56) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL21817064 0.87 TSHR (0.56) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL21360132 0.87 TSHR (0.56) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL4356482 0.87 TSHR (0.56) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL27747549 0.80 ALDH1A1 (0.50) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL2228694 0.79 NAAA (0.57) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL2228697 0.79 NAAA (0.57) TSHRNAAAHCAR2RAD52NPSR1
SCHEMBL28889641 0.79 NAAA (0.57) TSHRNAAAHCAR2RAD52NPSR1

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-6262213-B1 ANIONIC POLYMERIZATION OF ACRYLATS OR METHACRYLATES IN PRESENCE OF SOLVENT COMPRISING OLEFINICALLY UNSATURATED COMPOUND TO SUPPRESS GEL FORMATION OF REACTION MIXTURE BASF AKTIENGESELLSCHAFT (DE) 2001-07-17 US disclosed