SCHEMBL29257111

SCHEMBL29257111

CC1(C)OB(c2ccc(C3(O[SiH3])CC3)cc2)OC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 12/20 0.46
▸ LIPG Q9Y5X9 12/20 0.46
▸ CA1 P00915 3/20 0.43
▸ CA2 P00918 3/20 0.43
▸ CA9 Q16790 3/20 0.43
▸ CA12 O43570 1/20 0.40
▸ CA3 P07451 1/20 0.40
▸ CA4 P22748 1/20 0.40
▸ CA6 P23280 1/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ F11 P03951 2/20 0.39
▸ F2 P00734 1/20 0.37
▸ PRSS1 P07477 1/20 0.37
▸ PRSS2 P07478 1/20 0.37
▸ PRSS3 P35030 1/20 0.37
▸ ESR2 Q92731 1/20 0.36
▸ P4HB P07237 1/20 0.35

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
SCHEMBL28718475 0.87 LPL (0.44) LPLLIPGCA1CA2CA9
SCHEMBL16050350 0.85 LPL (0.47) LPLLIPGCA1CA2CA9
SCHEMBL31353150 0.80 LPL (0.42) LPLLIPGCA1CA2CA9
SCHEMBL12526662 0.78 LIPG (0.43) LPLLIPGCA1CA2CA9
SCHEMBL12845014 0.78 LPL (0.44) LPLLIPGCA1CA2CA9
SCHEMBL28490255 0.77 CA1 (0.44) LPLLIPGCA1CA2CA9
SCHEMBL19781782 0.77 LPL (0.41) LPLLIPGCA1CA2CA9
SCHEMBL14790161 0.77 LPL (0.53) LPLLIPGCA1CA2CA9
SCHEMBL19830980 0.77 LPL (0.53) LPLLIPGCA1CA2CA9
SCHEMBL31158444 0.76 LPL (0.42) LPLLIPGCA1CA2CA9

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-118355004-A Cyclopropyl- (heteroaryl) -substituted ethylsulfonyl-pyridine derivatives 勃林格殷格翰动物保健有限公司 2024-07-16 — — CN disclosed
Send feedback