SCHEMBL28397108

SCHEMBL28397108

CC=CNC(=O)OCCCC

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.48
ATM Q13315 1/20 0.48
ACHE P22303 14/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
HCAR2 Q8TDS4 1/20 0.43

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
Iodide SCHEMBL6370027 0.98 EPHX1 (0.47) EPHX1ATMACHEALDH1A1HPGD
SCHEMBL28401711 0.88 KDM4E (0.40) EPHX1ACHEALDH1A1HPGDHCAR2
SCHEMBL988902 0.84 ATM (0.52) EPHX1ATMACHEALDH1A1HPGD
SCHEMBL9956131 0.81 HCAR2 (0.58) EPHX1ATMACHEALDH1A1HPGD
SCHEMBL14321821 0.80 HPGD (0.50) EPHX1ATMACHEALDH1A1HPGD
SCHEMBL14321822 0.80 HPGD (0.50) EPHX1ATMACHEALDH1A1HPGD
SCHEMBL2946547 0.80 EPHX1 (0.44) EPHX1ATMACHEALDH1A1HPGD
SCHEMBL1274538 0.80 ATM (0.52) EPHX1ATMACHEALDH1A1HPGD
SCHEMBL7458595 0.80 ATM (0.52) EPHX1ATMACHEALDH1A1HPGD
SCHEMBL11114267 0.79

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
CN-111171210-A Tetrafluoroethylene-alkenyl carbamate-perfluoroalkyl vinyl ether dispersion resin and microporous membrane prepared therefrom 苏州世华新材料科技股份有限公司 2020-05-19 CN claimed