SCHEMBL22639804

SCHEMBL22639804

Cc1cc(=O)[nH]c(N/N=C/c2cccnc2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.62
▸ KDM4E B2RXH2 5/20 0.62
▸ GAA P10253 4/20 0.62
▸ ALDH1A1 P00352 4/20 0.62
▸ LMNA P02545 3/20 0.62
▸ MMP10 P09238 1/20 0.62
▸ MMP13 P45452 1/20 0.62
▸ HTT P42858 1/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.62
▸ ALPL P05186 1/20 0.62
▸ ALPI P09923 1/20 0.62
▸ ALPG P10696 1/20 0.62
▸ RXFP1 Q9HBX9 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ KMT2A Q03164 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ JMJD6 Q6NYC1 1/20 0.59
▸ CYP1A2 P05177 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58

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
SCHEMBL22639679 0.83 ALDH1A1 (0.51) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL30018123 0.77 MAPT (1.00) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL15762974 0.74 JMJD6 (1.00) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL8291377 0.74 KMT2A (1.00) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL880195 0.73 GAA (0.75) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL19425709 0.73 MAPT (0.87) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL15762973 0.69 JMJD6 (0.73) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL13779247 0.69 NPC1 (0.72) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL14027233 0.68 POLB (0.83) MAPTKDM4EGAAALDH1A1LMNA
SCHEMBL28255841 0.68 GFER (0.65) MAPTKDM4EGAAALDH1A1LMNA

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-10828281-B2 Non-hydrophobic compounds for use in treating metastasis and/or cartilage defect Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2020-11-10 — — 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-10828281-B2 Non-hydrophobic compounds for use in treating metastasis and/or cartilage defect VIM, MATR3, TP53 MAPT 168/4885KDM4E 4343/4885GAA 2575/4885

“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.

Send feedback