SCHEMBL4384744

SCHEMBL4384744

CCCCCCNc1nc2nc[nH]c2c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
XDH P47989 6/20 1.00
POLA1 P09884 1/20 0.59
GDA Q9Y2T3 1/20 0.54

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
SCHEMBL8535457 1.00 XDH (1.00) XDHPOLA1GDA
Hydrochloric Acid SCHEMBL258899 0.99 XDH (0.97) XDHPOLA1GDA
SCHEMBL249649 0.99 XDH (1.00) XDHPOLA1GDA
Hydrochloric Acid SCHEMBL30610398 0.97 XDH (0.95) XDHPOLA1GDA
SCHEMBL6272738 0.95 XDH (1.00) XDHPOLA1GDA
Acetic Acid SCHEMBL27671662 0.94 XDH (0.88) XDHPOLA1GDA
SCHEMBL667798 0.89 XDH (0.84) XDHPOLA1GDA
SCHEMBL16197989 0.87 XDH (0.77) XDHGDA
SCHEMBL27959660 0.87 XDH (0.77) XDHPOLA1GDA
SCHEMBL5935074 0.86 XDH (0.78) XDHPOLA1GDA

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-12279614-B2 Photo-polymerizable, universal antimicrobial coating to produce high-performing, multi-functional face masks THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2025-04-22 US disclosed
US-20230337670-A1 PHOTO-POLYMERIZABLE, UNIVERSAL ANTIMICROBIAL COATING TO PRODUCE HIGH-PERFORMING, MULTI-FUNCTIONAL FACE MASKS THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2023-10-26 US disclosed
WO-2009043899-A1 DRUG TRANSFER INTO LIVING CELLS COVALYS BIOSCIENCES AG (CH) 2009-04-09 WO disclosed
JP-2001055528-A RECEPTIVE INK AND PRINTING SUBSTRATE AND PRINTING ARTICLE USING SAME TEIKOKU PRINTING INKS MFG CO LTD 2001-02-27 JP 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-12279614-B2 Photo-polymerizable, universal antimicrobial coating to produce high-performing, multi-functional face masks CUTA, PUF60, PARN XDH 4396/4885POLA1 1476/4885GDA 2999/4885
US-20230337670-A1 PHOTO-POLYMERIZABLE, UNIVERSAL ANTIMICROBIAL COATING TO PRODUCE HIGH-PERFORMING, MULTI-FUNCTIONAL FACE MASKS CUTA, PUF60, PARN XDH 4396/4885POLA1 1476/4885GDA 2999/4885

“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.