SCHEMBL4715546

SCHEMBL4715546

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

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
ADORA2A P29274 2/20 0.45
CREBBP Q92793 1/20 0.42
CCR2 P41597 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
ALDH1A1 P00352 2/20 0.40
FEN1 P39748 1/20 0.40
MAPT P10636 1/20 0.39
FAAH O00519 1/20 0.39
ROCK2 O75116 1/20 0.38
ADRA1D P25100 1/20 0.38
CFTR P13569 1/20 0.38
DRD4 P21917 1/20 0.38

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
SCHEMBL4716129 0.87 CYP11B1 (0.41) ADORA2ACYP19A1CYP11B1CYP11B2ALDH1A1
SCHEMBL4713845 0.84 BRD4 (0.46) CREBBPALDH1A1
SCHEMBL4716315 0.82 ALDH1A1 (0.47) ALDH1A1MAPT
SCHEMBL4713858 0.82 MAPT (0.46) CYP11B1CYP11B2ALDH1A1MAPT
SCHEMBL4711849 0.79 TP53 (0.51) MAPT
SCHEMBL4761608 0.77 MAPT (0.36) L3MBTL1ALDH1A1MAPT
SCHEMBL4715863 0.77 CYP3A4 (0.46) L3MBTL1CCR2ALDH1A1MAPT
SCHEMBL4714110 0.76 LMNA (0.44) L3MBTL1CYP11B1CYP11B2ALDH1A1MAPT
SCHEMBL5113137 0.75 HTR6 (0.44) ALDH1A1
SCHEMBL4715873 0.75 TP53 (0.46) CYP11B1CYP11B2ALDH1A1MAPT

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-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
EP-1549648-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS Celltech R & D Limited (GB) 2005-07-06 EP disclosed
WO-2004031188-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS CELLTECH R & D LIMITED (GB) 2004-04-15 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-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors MAP2K2, MAP2K7, MAP2K3 L3MBTL1 2135/4885ADORA2A 2236/4885CREBBP 735/4885

“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.