SCHEMBL24525599

SCHEMBL24525599

CCCCNC(CCC(N)=O)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 6/20 0.45
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
KMT2A Q03164 3/20 0.38
SOAT1 P35610 2/20 0.38
MEN1 O00255 2/20 0.38
FAAH O00519 2/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALOX15 P16050 2/20 0.37
CNR1 P21554 1/20 0.36
KDM4E B2RXH2 2/20 0.35
DPP7 Q9UHL4 1/20 0.35
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
MAPK1 P28482 1/20 0.34
DNM1 Q05193 1/20 0.34
BCHE P06276 1/20 0.34

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
SCHEMBL7759612 0.88 NOD1 (0.57) NOD1KMT2AALOX15BLMPMP22
SCHEMBL7759622 0.88 NOD1 (0.57) NOD1KMT2AALOX15BLMPMP22
SCHEMBL28847291 0.86 NOD1 (0.49) NOD1KMT2ASOAT1MEN1FAAH
Hydrochloric Acid SCHEMBL27497436 0.86 NOD1 (0.56) NOD1KMT2AALOX15BLMPMP22
Hydrochloric Acid SCHEMBL27497106 0.86 NOD1 (0.56) NOD1KMT2AALOX15BLMPMP22
SCHEMBL627829 0.83 NOD1 (0.59) NOD1KMT2ASOAT1MEN1FAAH
SCHEMBL28835927 0.83 NOD1 (0.49) NOD1KMT2AMEN1ALOX15
SCHEMBL627830 0.83 NOD1 (0.59) NOD1KMT2ASOAT1MEN1FAAH
SCHEMBL2247417 0.83 NOD1 (0.49) NOD1KMT2AMEN1ALOX15
SCHEMBL29080980 0.82 NOD1 (0.43) NOD1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220193249-A1 Conjugates And Conjugating Reagents Comprising A Linker That Includes At Least Two (-CH2-CH2-O-) Units In A Ring POLYTHERICS LIMITED (GB) 2022-06-23 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-20220193249-A1 Conjugates And Conjugating Reagents Comprising A Linker That Includes At Least Two (-CH2-CH2-O-) Units In A Ring BCR, CD2BP2, LANCL1 NOD1 2834/4885CA1 1681/4885CA2 3835/4885

“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.