SCHEMBL10868613

SCHEMBL10868613

C=C(Cl)C(=O)OC(CCCCCCCC)OOC(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
PRSS1 P07477 3/20 0.38
CTSG P08311 2/20 0.38
CTRB1 P17538 2/20 0.38
CMA1 P23946 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CTSK P43235 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
CES2 O00748 2/20 0.37
CES1 P23141 2/20 0.37
LMNA P02545 4/20 0.37
NAAA Q02083 1/20 0.36
TSHR P16473 2/20 0.36
F2 P00734 1/20 0.36
ALOX12 P18054 1/20 0.36
CSNK1E P49674 1/20 0.34

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
SCHEMBL10870246 1.00 ALDH1A1 (0.42) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10869416 1.00 ALDH1A1 (0.42) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10869068 1.00 ALDH1A1 (0.42) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10870267 1.00 ALDH1A1 (0.42) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10867957 0.99 ALDH1A1 (0.40) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10870142 0.95 MEN1 (0.40) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10869569 0.89 ALDH1A1 (0.43) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10869509 0.89 ALDH1A1 (0.43) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10868656 0.89 ALDH1A1 (0.43) ALDH1A1PRSS1CTSGCTRB1CMA1
SCHEMBL10869661 0.89 ALDH1A1 (0.43) ALDH1A1PRSS1CTSGCTRB1CMA1

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-0184482-A1 Thermotropical polymers with chiral lateral chains, and process for their preparation THOMSON-CSF (FR) 1986-06-11 EP disclosed