SCHEMBL6412964

SCHEMBL6412964

N/N=C(\c1cccc(O)c1)c1nc2nonc2nc1Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
TP53 P04637 3/20 0.40
CCR2 P41597 1/20 0.40
CCR5 P51681 1/20 0.40
POLB P06746 1/20 0.39
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
GBA1 P04062 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
NPY5R Q15761 1/20 0.34
KDR P35968 3/20 0.34
PKMYT1 Q99640 1/20 0.34
PIM1 P11309 2/20 0.34
PIM2 Q9P1W9 1/20 0.34
MGLL Q99685 1/20 0.34
BRAF P15056 1/20 0.33

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
SCHEMBL6412976 1.00 MAPT (0.40) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6440257 0.91 TP53 (0.41) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6440251 0.91 TP53 (0.41) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6431156 0.89 TP53 (0.41) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6431148 0.89 TP53 (0.41) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6432179 0.89 MAPT (0.38) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6432166 0.89 MAPT (0.38) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6435294 0.88 CBS (0.45) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6435311 0.88 CBS (0.45) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6414695 0.86 PIM1 (0.40) MAPTSMN1; SMN2TP53POLBMEN1

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
US-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds 4SC AG (DE) 2005-06-30 US disclosed
WO-2005044270-A1 OXADIAZOLOPYRAZINE DERIVATIVES AS PHARMACEUTICALLY ACTIVE COMPOUNDS 4SC AG (DE) 2005-05-19 WO disclosed
EP-1529531-A1 Oxadiazolopyrazine derivatives as pharmaceutically active compounds 4SC AG (DE) 2005-05-11 EP 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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds NR5A2, NR1H2, NR2C2 MAPT 4420/4885SMN1; SMN2 4369/4885TP53 4485/4885

“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.