SCHEMBL4642046

SCHEMBL4642046

CCCOC(=O)c1ccc(OC(=O)CO)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
TSHR P16473 3/20 0.60
ESR1 P03372 3/20 0.60
TDP1 Q9NUW8 2/20 0.60
CHRM1 P11229 1/20 0.60
SLC6A2 P23975 1/20 0.60
KDR P35968 1/20 0.60
MAPT P10636 5/20 0.59
KMT2A Q03164 4/20 0.59
STS P08842 3/20 0.57
LMNA P02545 4/20 0.57
HPGD P15428 4/20 0.55
MEN1 O00255 2/20 0.55
THRB P10828 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
CYP2D6 P10635 1/20 0.53
MAPK1 P28482 1/20 0.53
NR1H2 P55055 1/20 0.53

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
SCHEMBL26153358 0.89 ALDH1A1 (0.62) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL10600799 0.89 ALDH1A1 (0.62) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL4642615 0.88 MAPT (0.57) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL7754276 0.87 ALDH1A1 (0.60) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL19373814 0.86 MAPT (0.70) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL4645066 0.86 ALDH1A1 (0.58) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL10598323 0.86 TSHR (0.58) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL4647749 0.86 KMT2A (0.62) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL4641659 0.85 MAPT (0.54) ALDH1A1TSHRESR1TDP1CHRM1
SCHEMBL4644757 0.84 KMT2A (0.54) ALDH1A1TSHRESR1TDP1CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN 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