SCHEMBL9406772

SCHEMBL9406772

CCCC[C@H]1CC[C@H](CCC(C(=O)OCC)C(=O)OCC)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
CYP1A2 P05177 1/20 0.41
NAAA Q02083 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
METAP2 P50579 1/20 0.39
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
PKM P14618 1/20 0.36
GAA P10253 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
SCHEMBL9406777 1.00 MAPT (0.49) MAPTCYP1A2NAAAPOLBHPGD
SCHEMBL21087908 0.91 MAPT (0.41) MAPTCYP1A2NAAAPOLBHPGD
SCHEMBL9650029 0.90 METAP2 (0.41) MAPTPOLBHPGDMETAP2LMNA
SCHEMBL9650034 0.90 METAP2 (0.41) MAPTPOLBHPGDMETAP2LMNA
SCHEMBL11018465 0.85 TDP1 (0.43) MAPTMETAP2HTTMAPK1TDP1
SCHEMBL8331302 0.84 METAP2 (0.51) CYP1A2POLBMETAP2TDP1MEN1
SCHEMBL28817738 0.83 METAP2 (0.46) CYP1A2NAAAMETAP2TDP1MEN1
SCHEMBL8330172 0.83 METAP2 (0.53) CYP1A2METAP2TDP1MEN1KMT2A
SCHEMBL10432708 0.83 MAPT (0.42) MAPTCYP1A2NAAAPOLBHPGD
SCHEMBL10707623 0.82 TP53 (0.42) MAPTCYP1A2NAAAPOLBHPGD

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
US-5354502-A Very large dielectric anisotropy and small birefringence SEIKO EPSON CORPORATION (JP) 1994-10-11 US disclosed