SCHEMBL8006519

SCHEMBL8006519

C=C(C)C(=O)OC(COC(=O)C(=C)CCOc1ccccc1)(OCC)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.38
MAPT P10636 3/20 0.38
NPC1 O15118 2/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
CASP6 P55212 1/20 0.36
LMNA P02545 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PKM P14618 1/20 0.35

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
SCHEMBL8018649 0.82 MEN1 (0.39) POLBTDP1APEX1HTTSMN1; SMN2
SCHEMBL11294405 0.79 TDP1 (0.54) POLBTDP1SMN1; SMN2MAPTNPC1
SCHEMBL691683 0.77 TDP1 (0.40) POLBTDP1APEX1HTTSMN1; SMN2
SCHEMBL8043107 0.73 THRB (0.57) SMN1; SMN2MAPTNPC1RAB9AMEN1
SCHEMBL7430087 0.73 TDP1 (0.56) POLBTDP1SMN1; SMN2MAPTNPC1
SCHEMBL7622862 0.72 KDM4E (0.37) POLBTDP1APEX1HTTSMN1; SMN2
SCHEMBL7436439 0.72 TDP1 (0.55) TDP1SMN1; SMN2MAPTNPC1GAA
SCHEMBL7182348 0.71 RECQL (0.55) SMN1; SMN2MAPTNPC1GAARAB9A
SCHEMBL28058450 0.71 RAB9A (0.53) SMN1; SMN2MAPTNPC1RAB9AMEN1
SCHEMBL28225095 0.71 POLB (0.48) POLBTDP1APEX1HTTSMN1; SMN2

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