SCHEMBL29128174

SCHEMBL29128174

Fc1cccc(OCc2c[nH]c(=S)[nH]2)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 3/20 0.40
▸ SLC6A4 P31645 3/20 0.40
▸ SLC6A3 Q01959 3/20 0.40
▸ HTR1A P08908 2/20 0.40
▸ DAO P14920 1/20 0.37
▸ FFAR1 O14842 1/20 0.35
▸ TRPA1 O75762 1/20 0.35
▸ SLC22A4 Q9H015 1/20 0.34
▸ KDM5A P29375 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ KDM5B Q9UGL1 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ METAP2 P50579 1/20 0.31
▸ MMP1 P03956 1/20 0.31
▸ MMP2 P08253 1/20 0.31
▸ MRGPRX4 Q96LA9 1/20 0.31
▸ KDM1A O60341 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ GAA P10253 1/20 0.30

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
SCHEMBL29128346 0.82 DAO (0.43) SLC6A2SLC6A4SLC6A3HTR1ADAO
SCHEMBL29128215 0.77 ALDH1A1 (0.49) SLC22A4TDP1L3MBTL1KDM4EGAA
SCHEMBL29128496 0.76 NPC1 (0.44) KDM4CTDP1KDM4E
SCHEMBL29128486 0.76 HTR1A (0.42) HTR1AKDM4EGAAGFER
SCHEMBL30799938 0.72 MAOB (0.39) DAOFFAR1TRPA1SLC22A4L3MBTL1
SCHEMBL29128567 0.72 MAOB (0.39) DAOFFAR1TRPA1SLC22A4L3MBTL1
SCHEMBL2741619 0.72 ADRA1A (0.57) SLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL29128498 0.71 GAA (0.43) DAOKDM4EGAAGFER
SCHEMBL29128298 0.70 L3MBTL1 (0.37) DAOKDM5AKDM4CKDM5BTDP1
SCHEMBL28246269 0.69 HTR1A (0.60) SLC6A2SLC6A4SLC6A3HTR1AFFAR1

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-117263862-A Phenol-1, 3-oxazole/dihydroimidazole-2-ketone/thioketone compound and synthesis and application thereof 吉首大学 2023-12-22 — — CN disclosed
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