SCHEMBL4713858

SCHEMBL4713858

Cc1cccc(Cn2ccc3c2ccc(=O)n3-c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
TP53 P04637 2/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 3/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
SLC2A1 P11166 1/20 0.42
BRD4 O60885 1/20 0.41
HTR6 P50406 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RGS4 P49798 1/20 0.40
RGS8 P57771 1/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CES2 O00748 1/20 0.40
ACHE P22303 1/20 0.39

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
SCHEMBL4713845 0.87 BRD4 (0.46) TP53ALDH1A1BRD4HTR6KDM4E
SCHEMBL4715873 0.86 TP53 (0.46) MAPTTP53POLBALDH1A1CYP11B1
SCHEMBL4716315 0.85 ALDH1A1 (0.47) MAPTTP53POLBALDH1A1KDM4E
SCHEMBL4711849 0.84 TP53 (0.51) MAPTTP53POLBSLC2A1MEN1
SCHEMBL4715546 0.82 L3MBTL1 (0.49) MAPTALDH1A1CYP11B1CYP11B2
SCHEMBL4715863 0.80 CYP3A4 (0.46) MAPTTP53POLBALDH1A1KDM4E
SCHEMBL4761608 0.80 MAPT (0.36) MAPTTP53POLBALDH1A1BRD4
SCHEMBL4714110 0.79 LMNA (0.44) MAPTTP53POLBALDH1A1CYP11B1
SCHEMBL5113137 0.78 HTR6 (0.44) ALDH1A1BRD4HTR6KDM4ELMNA
SCHEMBL4713444 0.78 POLB (0.44) MAPTTP53POLBALDH1A1CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456286-B2 Bicyclic heteroaromatic compounds as kinase inhibitors UCB PHARMA, S.A. (BE) 2008-11-25 US claimed
EP-0998459-B1 PYRIDINE DERIVATIVES NOVARTIS AG (CH) 2008-04-23 EP claimed
US-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors CELLTECH R&D LIMITED (GB) 2006-06-08 US claimed
US-7456286-B2 Bicyclic heteroaromatic compounds as kinase inhibitors UCB PHARMA, S.A. (BE) 2008-11-25 US disclosed
EP-1549648-B1 BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS UCB PHARMA SA (BE) 2008-11-12 EP disclosed
US-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors CELLTECH R&D LIMITED (GB) 2006-06-08 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-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors MAP2K2, MAP2K7, MAP2K3 MAPT 1831/4885TP53 740/4885POLB 964/4885

“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.