SCHEMBL6469778

SCHEMBL6469778

Oc1ccc(C=NNc2nc3nonc3nc2Nc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDX3X O00571 3/20 0.46
S100B P04271 1/20 0.45
AMY1A P0DUB6 1/20 0.44
GAA P10253 5/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
PKM P14618 2/20 0.43
XDH P47989 1/20 0.43
MAPT P10636 7/20 0.43
KDM4E B2RXH2 5/20 0.43
LRRK2 Q5S007 1/20 0.43
ALDH1A1 P00352 5/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
HPGD P15428 3/20 0.42
MAPK1 P28482 2/20 0.42
LMNA P02545 2/20 0.42
POLB P06746 2/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL6435805 0.88 MAPT (0.46) GAANPC1RAB9ASMN1; SMN2PKM
SCHEMBL6414699 0.87 MAPT (0.46) DDX3XGAANPC1RAB9ASMN1; SMN2
SCHEMBL6413566 0.87 BIRC5 (0.48) DDX3XGAANPC1RAB9ASMN1; SMN2
SCHEMBL6418252 0.87 RRM1 (0.49) DDX3XGAANPC1RAB9ASMN1; SMN2
SCHEMBL6414918 0.84 DDX3X (0.63) DDX3XGAANPC1RAB9ASMN1; SMN2
SCHEMBL6432629 0.83 KMT2A (0.56) DDX3XGAANPC1RAB9ASMN1; SMN2
SCHEMBL6432172 0.83 GAA (0.47) GAANPC1RAB9ASMN1; SMN2PKM
SCHEMBL6414142 0.82 MAPT (0.43) DDX3XGAANPC1RAB9ASMN1; SMN2
SCHEMBL6418326 0.80 GAA (0.47) GAANPC1RAB9ASMN1; SMN2PKM
SCHEMBL6415963 0.80 BIRC5 (0.52) DDX3XGAANPC1RAB9ASMN1; SMN2

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-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

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 DDX3X 2134/4885S100B 4529/4885AMY1A 4753/4885

“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.