SCHEMBL11033189

SCHEMBL11033189

C=CCC1CC(CC(=O)O)C(=O)O1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 2/20 0.33
CTRC Q99895 2/20 0.33
F2 P00734 1/20 0.33
POLB P06746 1/20 0.33
FAAH O00519 1/20 0.33
KMT2A Q03164 4/20 0.31
MAPT P10636 3/20 0.31
LMNA P02545 2/20 0.31
ELANE P08246 1/20 0.31
CTSG P08311 1/20 0.31
MEN1 O00255 3/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31
BLM P54132 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
ITGB3 P05106 1/20 0.30
ITGB2 P05107 1/20 0.30
ITGB1 P05556 1/20 0.30
ITGAV P06756 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
SCHEMBL9450611 0.83 PRSS1 (0.39) PRSS1CTRCF2POLBFAAH
SCHEMBL9450639 0.83 PRSS1 (0.39) PRSS1CTRCF2POLBFAAH
SCHEMBL9450640 0.83 PRSS1 (0.39) PRSS1CTRCF2POLBFAAH
SCHEMBL11220219 0.75 PRSS1 (0.36) PRSS1CTRCF2POLBFAAH
SCHEMBL5936331 0.72 HTT (0.52) KMT2AMAPTLMNAMEN1ALDH1A1
SCHEMBL30637093 0.71 POLB (0.51) POLBKMT2AMAPTLMNAMEN1
SCHEMBL576642 0.71 POLB (0.41) PRSS1CTRCF2POLBFAAH
SCHEMBL11221919 0.71 PRSS1 (0.36) PRSS1CTRCF2POLBFAAH
SCHEMBL17964259 0.70 FAAH (0.37) FAAHITGB3ITGB2ITGB1ITGAV
SCHEMBL17964253 0.69 TP53 (0.49) PRSS1CTRCF2FAAHITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4539127-A DETERGENTS AND DISPERSANTS FOR LUBRICANTS AND GASOLINE MOBIL OIL CORPORATION (US) 1985-09-03 US disclosed
US-4329286-A Hydroxyamide acid products and butyrolactone and butyrolactam products MOBIL OIL CORPORATION (US) 1982-05-11 US disclosed
US-4190588-A FROM AN ALKENYL SUCCINIC ANHYDRIDE MOBIL OIL CORPORATION (US) 1980-02-26 US disclosed