SCHEMBL28769722

SCHEMBL28769722

CC1(C)OB(c2ccc(CBr)nc2)OC1(C)C

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.44
LPL P06858 12/20 0.44
LIPG Q9Y5X9 12/20 0.44
F11 P03951 1/20 0.39
FFAR1 O14842 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
CA12 O43570 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36

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
SCHEMBL29744209 0.85 LPL (0.49) DGAT1LPLLIPGF11FFAR1
SCHEMBL2426973 0.85 LPL (0.49) DGAT1LPLLIPGF11FFAR1
SCHEMBL31469579 0.83 LPL (0.45) DGAT1LPLLIPGF11FFAR1
SCHEMBL2428561 0.83 LPL (0.45) DGAT1LPLLIPGF11FFAR1
SCHEMBL2316680 0.83 DGAT1 (0.47) DGAT1LPLLIPGF11FFAR1
SCHEMBL3803828 0.83 DGAT1 (0.44) DGAT1LPLLIPGF11FFAR1
SCHEMBL14873045 0.82 DGAT1 (0.49) DGAT1LPLLIPGF11FFAR1
SCHEMBL23816604 0.81 DGAT1 (0.45) DGAT1LPLLIPGF11FFAR1
SCHEMBL15941165 0.81 DGAT1 (0.42) DGAT1LPLLIPGF11FFAR1
SCHEMBL30064074 0.81 DGAT1 (0.45) DGAT1LPLLIPGF11FFAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114394965-B Triazolopyridine compound and preparation method and application thereof 深圳市乐土生物医药有限公司 2023-09-12 CN disclosed
CN-114394965-A Triazolopyridine compound and preparation method and application thereof 深圳市乐土生物医药有限公司 2022-04-26 CN disclosed