SCHEMBL6988092

SCHEMBL6988092

O=C(O)c1c[nH]c(=O)c(C(=O)O)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.62
NOTUM Q6P988 2/20 0.54
KDM4E B2RXH2 5/20 0.47
NAPRT Q6XQN6 1/20 0.45
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
KDM3B Q7LBC6 1/20 0.42
GAA P10253 1/20 0.42
ALDH1A1 P00352 2/20 0.39
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
LDHA P00338 1/20 0.38
KMT2A Q03164 1/20 0.36
F7 P08709 1/20 0.35
F3 P13726 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 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
SCHEMBL30647261 0.86 NOTUM (0.48) DYRK1ANOTUMKDM4ENAPRTKDM3B
SCHEMBL31702834 0.83 NOTUM (0.50) DYRK1ANOTUMKDM4ENAPRTHPGD
SCHEMBL10686600 0.81 KDM4E (0.51) DYRK1AKDM4ENAPRTHSD17B10ALDH1A1
SCHEMBL20494535 0.81 NOTUM (0.48) DYRK1ANOTUMKDM4EKMT2A
SCHEMBL6208318 0.78 NOTUM (0.54) DYRK1ANOTUMKDM4EHPGDHSD17B10
SCHEMBL4037213 0.77 PKM (0.54) DYRK1ANOTUMKDM4EKDM3BSMN1; SMN2
SCHEMBL22114512 0.77 NOTUM (0.52) DYRK1ANOTUMKDM4EHPGDHSD17B10
SCHEMBL2704343 0.77 NOTUM (0.52) DYRK1ANOTUMKDM4EHPGDKDM3B
SCHEMBL480033 0.77 NOTUM (0.63) DYRK1ANOTUMKDM4EHPGDHSD17B10
SCHEMBL4542707 0.77 NOTUM (0.52) DYRK1ANOTUMCSNK2A2CSNK2BCSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1362033-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-11-19 EP claimed
WO-2002064568-A1 PYRIDINE MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed
US-20250388543-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-12-25 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 (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-20250388543-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN SCN8A, SCN1B, SCN3A DYRK1A 3125/4885NOTUM 3371/4885KDM4E 4442/4885

“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.