SCHEMBL28512561

SCHEMBL28512561

FC(F)(F)c1ccccc1-c1ccccc1.N=C=O.N=C=O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
HSD11B1 P28845 2/20 0.46
SLC13A5 Q86YT5 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
SCN9A Q15858 2/20 0.43
KMO O15229 2/20 0.43
CNR2 P34972 1/20 0.40
BACE1 P56817 1/20 0.40
C1R P00736 1/20 0.40
TRPA1 O75762 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
MME P08473 1/20 0.39
DPP4 P27487 1/20 0.39

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
SCHEMBL20472968 0.88 ALDH1A1 (0.49) ARALDH1A1HPGDHSD11B1KMO
SCHEMBL163729 0.88 HSD11B1 (0.55) ARALDH1A1HPGDFFAR4HSD11B1
SCHEMBL28231445 0.86 HSD11B1 (0.44) ARALDH1A1HPGDFFAR4HSD11B1
Hydrogen Sulfide SCHEMBL27686805 0.86 HSD11B1 (0.53) ARALDH1A1HPGDFFAR4HSD11B1
Methane SCHEMBL28022370 0.86 HSD11B1 (0.53) ARALDH1A1HPGDFFAR4HSD11B1
Water SCHEMBL7091891 0.86 AR (0.55) ARALDH1A1HPGDFFAR4HSD11B1
Benzene SCHEMBL29143034 0.86 AR (0.50) ARALDH1A1HPGDFFAR4HSD11B1
Water SCHEMBL27916635 0.86 AR (0.55) ARALDH1A1HPGDFFAR4HSD11B1
Ammonia Solution, Strong SCHEMBL28126322 0.86 HSD11B1 (0.53) ARALDH1A1HPGDFFAR4HSD11B1
Ethyne SCHEMBL27849625 0.86 HSD11B1 (0.53) ARALDH1A1HPGDFFAR4HSD11B1

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-108368264-B Polyamide-imide, method for producing same, and polyamide-imide film using same 株式会社LG化学 2021-01-22 CN disclosed