SCHEMBL22489682

SCHEMBL22489682

CN(C)c1ccc(CC(=O)N2CCN(c3ccc(Cl)nn3)CC2)nn1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PANK3 Q9H999 16/20 0.66
TRPV1 Q8NER1 1/20 0.47
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 1/20 0.41

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
SCHEMBL22489675 0.89 PANK3 (0.58) PANK3TRPV1LMNAHTTMEN1
SCHEMBL22489686 0.84 PANK3 (0.68) PANK3
SCHEMBL22489685 0.83 PANK3 (0.60) PANK3TRPV1LMNAHTTCYP1A2
SCHEMBL22489681 0.82 PANK3 (0.58) PANK3TRPV1LMNAHTTMEN1
SCHEMBL22489694 0.81 PANK3 (0.56) PANK3TRPV1LMNAHTTMEN1
SCHEMBL22489203 0.80 PANK3 (1.00) PANK3
SCHEMBL22489689 0.79 PANK3 (0.54) PANK3TRPV1LMNAHTTMEN1
SCHEMBL22489619 0.79 PANK3 (0.74) PANK3
SCHEMBL19748456 0.74 PANK3 (1.00) PANK3
SCHEMBL22489528 0.73 PANK3 (0.78) PANK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220185796-A1 SMALL MOLECULE MODULATORS OF PANK ST. JUDE CHILDREN'S RESEARCH HOSPITAL 2022-06-16 US disclosed
WO-2020198526-A2 SMALL MOLECULE MODULATORS OF PANK ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2020-10-01 WO 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-20220185796-A1 SMALL MOLECULE MODULATORS OF PANK PANK2, PANK1, PANK3 PANK3 3/4885TRPV1 1065/4885LMNA 2078/4885

“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.