SCHEMBL19781334

SCHEMBL19781334

C[Si](C)(C)C#Cc1ccc(Cl)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.33
KMO O15229 1/20 0.32
GABRA1 P14867 4/20 0.32
GABRG2 P18507 4/20 0.32
GABRB3 P28472 4/20 0.32
GABRA5 P31644 4/20 0.32
GABRA3 P34903 4/20 0.32
GABRA2 P47869 4/20 0.32
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
HTR2A P28223 1/20 0.31
SLC6A4 P31645 1/20 0.31
KCNH2 Q12809 1/20 0.31
GABRA4 P48169 2/20 0.30
GABRA6 Q16445 2/20 0.30
GRM5 P41594 2/20 0.30
PGR P06401 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
SCHEMBL10163925 0.82 PYGL (0.40) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL1477690 0.82 GRM5 (0.43) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL23851284 0.79 GRM5 (0.36) KMOGABRA1GABRG2GABRB3GABRA5
SCHEMBL19781318 0.79
SCHEMBL8771367 0.79 CYP1A1 (0.39) RAPGEF4FFAR1FFAR4HTR2ASLC6A4
SCHEMBL19748358 0.78 KDM1A (0.33) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL5993333 0.78 ALDH1A1 (0.42) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL19781336 0.78
SCHEMBL2805739 0.76 ACACB (0.43) KMOFFAR4
SCHEMBL4683351 0.76 RAB9A (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12275718-B2 Small molecule inhibitors of galectin-3 BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-15 US disclosed
US-11939349-B2 Galactoside inhibitor of galectins GALECTO BIOTECH AB (DK) 2024-03-26 US disclosed
US-20220380401-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS GALECTO BIOTECH AB (DK) 2022-12-01 US disclosed
US-11447517-B2 Galactoside inhibitor of galectins GALECTO BIOTECH AB (DK) 2022-09-20 US disclosed
US-20220017558-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS GALECTO BIOTECH AB (DK) 2022-01-20 US disclosed
US-20220009913-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2022-01-13 US disclosed
EP-3891144-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 Bristol-Myers Squibb Company (US) 2021-10-13 EP disclosed
EP-3883946-A1 ALPHA-D-GALACTOSIDE INHIBITORS OF GALECTINS Galecto Biotech AB (DK) 2021-09-29 EP disclosed
CN-113412267-A alpha-D-galactoside inhibitors of galectins 格莱克特生物技术公司 2021-09-17 CN disclosed
US-20210147408-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2021-05-20 US disclosed
WO-2020117883-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-11 WO disclosed
WO-2019067702-A9 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL-MYERS SQUIBB COMPANY (US) 2019-04-25 WO disclosed
WO-2019067702-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL-MYERS SQUIBB COMPANY (US) 2019-04-04 WO disclosed
CN-109563119-A α-D- galactoside the inhibitor of galactose agglutinin 格莱克特生物技术公司 2019-04-02 CN disclosed
WO-2018011094-A1 ALPHA-D-GALACTOSIDE INHIBITORS OF GALECTINS GALECTO BIOTECH AB (DK) 2018-01-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210147408-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 LGALS3, LGALS1, LGALS3BP RAPGEF4 3375/4885KMO 3468/4885GABRA1 3263/4885
US-20220017558-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS LGALS1, LGALS3, LGALS2 RAPGEF4 3278/4885KMO 3296/4885GABRA1 3564/4885
US-20220380401-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS LGALS1, LGALS3, LGALS2 RAPGEF4 3278/4885KMO 3296/4885GABRA1 3564/4885
US-20220009913-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 LGALS3, LGALS1, LGALS3BP RAPGEF4 3375/4885KMO 3468/4885GABRA1 3263/4885
US-12275718-B2 Small molecule inhibitors of galectin-3 LGALS3, LGALS1, LGALS3BP RAPGEF4 3375/4885KMO 3468/4885GABRA1 3263/4885
US-11939349-B2 Galactoside inhibitor of galectins LGALS1, LGALS3, LGALS2 RAPGEF4 3638/4885KMO 3027/4885GABRA1 3375/4885
US-11447517-B2 Galactoside inhibitor of galectins LGALS1, LGALS3, LGALS2 RAPGEF4 3638/4885KMO 3027/4885GABRA1 3375/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.