SCHEMBL24686402

SCHEMBL24686402

CCC(F)(F)n1cc(B2OC(C)(C)C(C)(C)O2)cn1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.52
▸ LPL P06858 8/20 0.36
▸ LIPG Q9Y5X9 8/20 0.36
▸ AAK1 Q2M2I8 1/20 0.33
▸ F11 P03951 3/20 0.32
▸ F2 P00734 2/20 0.32
▸ PRSS1 P07477 2/20 0.32
▸ PRSS2 P07478 2/20 0.32
▸ PRSS3 P35030 2/20 0.32
▸ DGAT1 O75907 1/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.31

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
SCHEMBL2752557 0.84 FFAR1 (0.54) FFAR1LPLLIPGAAK1F11
SCHEMBL17904530 0.84 FFAR1 (0.57) FFAR1LPLLIPGAAK1F11
SCHEMBL19861553 0.83 FFAR1 (0.56) FFAR1LPLLIPGAAK1F11
SCHEMBL2588010 0.80 FFAR1 (0.59) FFAR1LPLLIPGAAK1DGAT1
SCHEMBL19524038 0.78 FFAR1 (0.61) FFAR1LPLLIPGAAK1F11
SCHEMBL34468062 0.78 FFAR1 (0.57) FFAR1LPLLIPGAAK1DGAT1
SCHEMBL19540284 0.78 FFAR1 (0.54) FFAR1LPLLIPGAAK1DGAT1
SCHEMBL24686401 0.78 FFAR1 (0.48) FFAR1LPLLIPGAAK1F11
SCHEMBL14746347 0.77 FFAR1 (0.56) FFAR1LPLLIPGAAK1F11
SCHEMBL13412137 0.77 FFAR1 (0.59) FFAR1LPLLIPGAAK1F11

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
WO-2022161416-A1 AROMATIC COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 武汉朗来科技发展有限公司 2022-08-04 — — WO disclosed
Send feedback