SCHEMBL4642134

SCHEMBL4642134

CCC[CH]C(=O)Oc1ccccc1C(=O)OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 3/20 0.55
KMT2A Q03164 5/20 0.49
HTT P42858 1/20 0.49
MAPT P10636 3/20 0.48
SLC6A4 P31645 1/20 0.47
PRSS1 P07477 1/20 0.45
ACR P10323 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
HSD17B10 Q99714 3/20 0.44
HPGD P15428 3/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
ATM Q13315 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CFTR P13569 1/20 0.42
CYP1A2 P05177 1/20 0.41
HSP90AA1 P07900 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL4644831 0.88 SLC6A3 (0.58) SLC6A3KMT2AHTTMAPTSLC6A4
SCHEMBL4646795 0.81 POLB (0.45) KMT2AHTTMAPTPRSS1ACR
SCHEMBL28398990 0.81 HSD17B10 (0.66) SLC6A3KMT2AHTTMAPTSLC6A4
SCHEMBL4647858 0.80 SLC6A3 (0.63) SLC6A3KMT2AHTTMAPTSLC6A4
SCHEMBL4643846 0.78 GAA (0.43) KMT2AHTTMAPTHSD17B10HPGD
Methyl Salicylate Acrylic Ester SCHEMBL1054590 0.78 SLC6A3 (0.61) SLC6A3KMT2AHTTMAPTSLC6A4
SCHEMBL4102059 0.78 MAPT (0.54) SLC6A3KMT2AHTTMAPTPRSS1
SCHEMBL4102064 0.78 MAPT (0.54) SLC6A3KMT2AHTTMAPTPRSS1
SCHEMBL4641769 0.77 THRA (0.45) KMT2AMAPTL3MBTL1KDM4ETSHR
SCHEMBL4642014 0.77 PTGDR2 (0.49) KMT2AHTTHPGDLMNAMEN1

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
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed