SCHEMBL8006786

SCHEMBL8006786

C=C(C)C(=O)OCCOC.C=C(CCOc1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
APEX1 P27695 1/20 0.49
HTT P42858 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
HPGD P15428 1/20 0.43
THRB P10828 1/20 0.43
RAB9A P51151 6/20 0.40
MAPT P10636 5/20 0.40
NPC1 O15118 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
Methacrylic Acid SCHEMBL17911799 0.83 TDP1 (0.58) POLBAPEX1HTTTDP1KMT2A
SCHEMBL21371 0.83 TDP1 (0.61) POLBAPEX1HTTTDP1KMT2A
SCHEMBL8020302 0.82 LMNA (0.44) POLBAPEX1HTTTDP1HPGD
SCHEMBL28331865 0.82 TDP1 (0.60) POLBAPEX1HTTTDP1KMT2A
SCHEMBL44088 0.82 CYP1A2 (0.54) KMT2AMEN1THRBRAB9ANPC1
Methacrylic Acid SCHEMBL2427050 0.81 POLB (0.53) POLBAPEX1HTTTDP1KMT2A
Acrylic Acid SCHEMBL2464234 0.81 THRB (0.45) POLBAPEX1HTTTDP1KMT2A
SCHEMBL28225095 0.81 POLB (0.48) POLBAPEX1HTTTDP1KMT2A
SCHEMBL15936108 0.81 POLB (0.56) POLBAPEX1HTTTDP1KMT2A
SCHEMBL3861027 0.81 THRB (0.54) POLBAPEX1HTTTDP1THRB

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
WO-2000034804-A1 HIGH REFRACTIVE INDEX HYDROGEL COMPOSITIONS FOR OPHTHALMIC IMPLANTS BAUSCH & LOMB SURGICAL, INC. (US) 2000-06-15 WO disclosed