SCHEMBL7889268

SCHEMBL7889268

CC(C)CCn1c(Cn2c(=O)n(C)c(=O)c3ccccc32)nc2cc(CN)ccc21

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
MAPK1 P28482 2/20 0.44
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL6264028 0.88 NPSR1 (0.45) TSHRMAPK1POLBMAPTBCHE
SCHEMBL7879899 0.88 MEN1 (0.44) TSHRMAPK1POLBMAPTBCHE
SCHEMBL6244317 0.85 TSHR (0.46) TSHRMAPK1BCHEACHECNR2
SCHEMBL31069342 0.82 CNR2 (0.41) CNR2
SCHEMBL31069352 0.81 CNR2 (0.41) BCHEACHECNR2
SCHEMBL6249078 0.80 TSHR (0.45) TSHRMAPK1LMNAHTTBCHE
SCHEMBL6500097 0.79 CNR2 (0.42) TSHRMAPK1BCHEACHECNR2
SCHEMBL6242050 0.79 CYP3A4 (0.46) TSHRMAPK1POLBBCHEACHE
SCHEMBL6245024 0.77 NPSR1 (0.44) TSHRMAPK1POLBBCHEACHE
SCHEMBL6278010 0.77 TSHR (0.44) TSHRMAPK1BCHEACHECNR2

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-20100278835-A1 NOVEL COMPOUNDS 660 ASTRAZENECA UK LIMITED (GB) 2010-11-04 US disclosed
US-20100278835-A1 NOVEL COMPOUNDS 660 ASTRAZENECA UK LIMITED (GB) 2010-11-04 US disclosed
WO-2010103306-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS ANTIVARAL AGENTS ASTRAZENECA UK LIMITED (GB) 2010-09-16 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-20100278835-A1 NOVEL COMPOUNDS 660 RB1, RPP30, SARS1 TSHR 548/4885MAPK1 2919/4885POLB 1878/4885

“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.