SCHEMBL13801151

SCHEMBL13801151

c1nnc(-c2nc3sc(-c4nnco4)nc3s2)o1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 13/20 0.42
CDC7 O00311 1/20 0.39
DBF4 Q9UBU7 1/20 0.39
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
TSHR P16473 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TLR8 Q9NR97 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
SCHEMBL13801153 0.83 NOTUM (0.55) NOTUMCDC7DBF4MAPTALDH1A1
SCHEMBL12906161 0.72 NOTUM (0.59) NOTUMMAPTALDH1A1HPGDMAPK1
SCHEMBL5067577 0.72 ALDH1A1 (0.36) NOTUMMAPTALDH1A1
SCHEMBL4766812 0.70 NOTUM (0.42) NOTUMMAPTALDH1A1TSHRTLR8
SCHEMBL25144924 0.68 NOTUM (0.43) NOTUMCDC7DBF4MAPTALDH1A1
SCHEMBL21547878 0.68 NOTUM (0.43) NOTUMCDC7DBF4MAPTALDH1A1
SCHEMBL21539002 0.65 NOTUM (0.44) NOTUMCDC7DBF4MAPTALDH1A1
SCHEMBL21366093 0.65 NOTUM (0.40) NOTUMCDC7DBF4MAPTALDH1A1
SCHEMBL21366186 0.65 NOTUM (0.36) NOTUMCDC7DBF4MAPTALDH1A1
SCHEMBL21547804 0.65 NOTUM (0.44) NOTUMCDC7DBF4MAPTALDH1A1

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-20090156827-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS AND ORGANIC ELECTROLUMINESCENT ELEMENT TOYO INK MFG. CO., LTD. (JP) 2009-06-18 US disclosed
US-20090156827-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS AND ORGANIC ELECTROLUMINESCENT ELEMENT TOYO INK MFG. CO., LTD. (JP) 2009-06-18 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-20090156827-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS AND ORGANIC ELECTROLUMINESCENT ELEMENT ELP1, ELAVL1, ELF3 NOTUM 3406/4885CDC7 4772/4885DBF4 2647/4885

“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.