SCHEMBL3710138

SCHEMBL3710138

CSc1cnc(Cl)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
NPSR1 Q6W5P4 4/20 0.37
KMT2A Q03164 3/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
MEN1 O00255 2/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.34
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
GFER P55789 1/20 0.32
HAO1 Q9UJM8 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 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
SCHEMBL30088418 1.00 ALDH1A1 (0.37) ALDH1A1NPSR1KMT2AL3MBTL1MEN1
SCHEMBL16139566 0.80 CHRNB2 (0.40) ALDH1A1KMT2AL3MBTL1MEN1HTT
SCHEMBL7678786 0.77 ALDH1A1 (0.38) ALDH1A1NPSR1MAPTCHRNB2CHRNB4
SCHEMBL21736844 0.77 SLC5A2 (0.32) ALDH1A1KMT2AL3MBTL1MEN1HTT
SCHEMBL7678927 0.77 ALDH1A1 (0.41) ALDH1A1NPSR1KMT2AHTTMAPT
SCHEMBL21736843 0.75 RAB9A (0.37) ALDH1A1KMT2AL3MBTL1MEN1HTT
SCHEMBL21718403 0.75 MEN1 (0.30) ALDH1A1KMT2AL3MBTL1MEN1HTT
SCHEMBL11162295 0.74 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1HTTMAPT
SCHEMBL9779771 0.72 KMT2A (0.51) ALDH1A1KMT2AL3MBTL1MEN1HTT
SCHEMBL9779716 0.72 KMT2A (0.40) ALDH1A1KMT2AL3MBTL1MEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212138-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND THEIR USE AKEBIA THERAPEUTICS, INC. (US) 2023-07-06 US disclosed
US-20230212138-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND THEIR USE AKEBIA THERAPEUTICS, INC. (US) 2023-07-06 US disclosed
US-20230212138-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND THEIR USE AKEBIA THERAPEUTICS, INC. (US) 2023-07-06 US disclosed
EP-4121424-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND THEIR USE Akebia Therapeutics Inc. (US) 2023-01-25 EP disclosed
CN-115605467-A PHD inhibitor compounds, compositions and uses thereof 阿克比治疗有限公司(US) 2023-01-13 CN disclosed
WO-2021188944-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND THEIR USE AKEBIA THERAPEUTICS, INC. (US) 2021-09-23 WO disclosed
WO-2021188944-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND THEIR USE AKEBIA THERAPEUTICS, INC. (US) 2021-09-23 WO disclosed
WO-2018019711-A1 SUBSTITUTED HALOGEN(THIO)ACYL COMPOUNDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-02-01 WO disclosed
WO-2010092342-A1 ORGANOSILICON COMPOUNDS AND THEIR USE AS THE MODULATORS OF THE TRPV1 RECEPTOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-19 WO disclosed
US-6448205-B1 FOR THE DESICCATION AND/OR DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2002-09-10 US disclosed
WO-1998007720-A1 SUBSTITUTED 2-ARYLPYRIDINE AS HERBICIDE BASF AKTIENGESELLSCHAFT (DE) 1998-02-26 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 (1 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-20230212138-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND THEIR USE HIF1AN, EGLN3, EGLN2 ALDH1A1 904/4885NPSR1 4535/4885KMT2A 236/4885

“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.