SCHEMBL20856483

SCHEMBL20856483

NNc1cc(Cl)cnc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ATF1 P18846 4/20 0.34
NFKB1 P19838 4/20 0.34
IDO1 P14902 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GRIN2B Q13224 2/20 0.31
KCNH2 Q12809 1/20 0.31
PDK2 Q15119 1/20 0.30
XPO1 O14980 2/20 0.30
PLAU P00749 1/20 0.30
JUN P05412 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
GLA P06280 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
Hydrochloric Acid SCHEMBL20856493 0.98 HTT (0.37) HTTHSD17B10ATF1NFKB1IDO1
SCHEMBL30626892 0.78 PLA2G1B (0.35) HTTIDO1KDM4EMAPTALDH1A1
SCHEMBL24557904 0.78 PLA2G1B (0.35) HTTIDO1KDM4EMAPTALDH1A1
SCHEMBL20856630 0.75 HSD17B10 (0.41) HTTHSD17B10ATF1NFKB1IDO1
SCHEMBL17964135 0.74 HTT (0.43) HTTHSD17B10ATF1NFKB1IDO1
SCHEMBL25243124 0.74 KDM4E (0.30) KDM4EMAPTALDH1A1L3MBTL1POLB
SCHEMBL25584916 0.72 HTT (0.42) HTTHSD17B10ATF1NFKB1IDO1
SCHEMBL25599692 0.72 HTT (0.42) HTTHSD17B10ATF1NFKB1IDO1
SCHEMBL29743287 0.72 HTT (0.42) HTTHSD17B10ATF1NFKB1IDO1
SCHEMBL2260139 0.71 PLAU (0.42) HTTHSD17B10ATF1NFKB1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3947407-B1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2024-06-12 EP disclosed
CN-117043156-A Novel galectin inhibitors of galectins 格莱克特生物技术公司 2023-11-10 CN disclosed
EP-4267570-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS Galecto Biotech AB (DK) 2023-11-01 EP disclosed
WO-2023118267-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS GALECTO BIOTECH AB (DK) 2023-06-29 WO disclosed
WO-2022136365-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS GALECTO BIOTECH AB (DK) 2022-06-30 WO disclosed
WO-2022136365-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS GALECTO BIOTECH AB (DK) 2022-06-30 WO disclosed
US-20220185800-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2022-06-16 US disclosed
EP-3947407-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 Bristol-Myers Squibb Company (US) 2022-02-09 EP disclosed
CN-113727988-A Small molecule inhibitors of galectin-3 百时美施贵宝公司 2021-11-30 CN disclosed
US-20210147408-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL MYERS SQUIBB CO (US) 2021-05-20 US disclosed
WO-2020198266-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL-MYERS SQUIBB COMPANY (US) 2020-10-01 WO disclosed
WO-2020198266-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL-MYERS SQUIBB COMPANY (US) 2020-10-01 WO disclosed
WO-2019067702-A9 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL-MYERS SQUIBB COMPANY (US) 2019-04-25 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
WO-2019067702-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 BRISTOL-MYERS SQUIBB COMPANY (US) 2019-04-04 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 (2 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-20220185800-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 LGALS3, LGALS1, LGALS3BP HTT 3682/4885HSD17B10 3494/4885ATF1 2244/4885
US-20210147408-A1 SMALL MOLECULE INHIBITORS OF GALECTIN-3 LGALS3, LGALS1, LGALS3BP HTT 3565/4885HSD17B10 3634/4885ATF1 2130/4885

“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.