SCHEMBL28035818

SCHEMBL28035818

CCCOC(=O)/C=C/C(=O)OC=C(C)C

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 6/20 0.60
ATM Q13315 1/20 0.53
MAPT P10636 2/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
APP P05067 3/20 0.41
ALOX5 P09917 1/20 0.40
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL27668230 0.89 ATM (0.71) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL27952655 0.84 HCAR2 (0.57) HCAR2ATMMAPTNPSR1ALDH1A1
SCHEMBL448454 0.83 HCAR2 (0.82) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL448456 0.83 HCAR2 (0.82) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL322228 0.83 HCAR2 (0.82) HCAR2ATMMAPTRAB9ANPSR1
Hydrochloric Acid SCHEMBL28061109 0.81 HCAR2 (0.78) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL4934756 0.81 HCAR2 (0.78) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL28167533 0.81 HCAR2 (0.43) HCAR2ATMTSHRALDH1A1
SCHEMBL27935730 0.81 HCAR2 (0.43) HCAR2ATMTSHRALDH1A1
SCHEMBL8630466 0.81 HCAR2 (0.43) HCAR2ATMTSHRALDH1A1

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-103601845-B Polyisobutene butene dioic acid ester and preparation method thereof and by this polyester for micro lubricating oil Shanghai Jinzhao Conservation of Energy Science & Technology Co., Ltd. (CN) 2015-11-11 CN disclosed