SCHEMBL3060385

SCHEMBL3060385

Cc1cc(N)c(C(=O)O)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.39
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
NOTUM Q6P988 2/20 0.39
MAP4K1 Q92918 1/20 0.37
DAO P14920 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
PARP1 P09874 1/20 0.35
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 2/20 0.33
GFER P55789 2/20 0.33
POLB P06746 2/20 0.33
PKM P14618 2/20 0.33
NPY1R P25929 1/20 0.33
NPY2R P49146 1/20 0.33
TPMT P51580 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL7471247 0.83 PDPK1 (0.45) KDM4EKMT2AMEN1TDP1MAP4K1
SCHEMBL5175210 0.79 KDM4E (0.37) KDM4EKMT2AMEN1TDP1DAO
SCHEMBL15436509 0.78 PTPN11 (0.43) KDM4EKMT2AMEN1TDP1MAP4K1
SCHEMBL1044787 0.77 NOTUM (0.41) KDM4EKMT2AMEN1NOTUMDAO
SCHEMBL1681378 0.75 ALDH1A1 (0.50) KDM4EKMT2AMEN1HPGDHSD17B10
SCHEMBL6622235 0.74 NOTUM (0.39) KDM4EKMT2AMEN1NOTUMDAO
SCHEMBL3105456 0.74 NOTUM (0.39) NOTUMDAOHCAR2
SCHEMBL31386913 0.74 NOTUM (0.39) KDM4EKMT2AMEN1NOTUMDAO
SCHEMBL3579630 0.71 FABP3 (0.42) NOTUMDAOHCAR2GABRA1GABRB1
SCHEMBL19350085 0.71 ADORA1 (0.39) NOTUMDAOHCAR2GAAGPR35

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 US disclosed
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-09-17 US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 US 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 (3 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-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 KDM4E 4164/4885KMT2A 1844/4885MEN1 799/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 KDM4E 4164/4885KMT2A 1844/4885MEN1 799/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 KDM4E 4164/4885KMT2A 1844/4885MEN1 799/4885

“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.