SCHEMBL4879470

SCHEMBL4879470

CCOC(=O)c1csc(N2CCC(n3ccc4c(Cl)c(C)[nH]c4c3=O)CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 1/20 0.42
▸ PARP1 P09874 1/20 0.41
▸ TNK2 Q07912 1/20 0.41
▸ TNK1 Q13470 1/20 0.41
▸ MAPT P10636 6/20 0.37
▸ LMNA P02545 3/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ POLB P06746 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ HRH3 Q9Y5N1 2/20 0.36
▸ GAA P10253 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ NPC1 O15118 3/20 0.35

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
SCHEMBL4880729 0.89 PTGER1 (0.39) OGAHRH3SMN1; SMN2NPC1RAB9A
SCHEMBL4878363 0.82 MAPT (0.37) MAPTLMNANPSR1POLBALDH1A1
SCHEMBL4869961 0.79 PIK3CA (0.51) MAPTALDH1A1HRH3MAPK1HTT
SCHEMBL4868563 0.76 ABCC2 (0.45) HRH3
SCHEMBL4869669 0.74 PARP1 (0.44) OGAPARP1TNK2TNK1MAPT
SCHEMBL4874945 0.73 ITGAL (0.38) MAPTLMNAPOLBALDH1A1MEN1
SCHEMBL3281679 0.73 LMNA (0.44) LMNAPOLBL3MBTL1MAPK1
SCHEMBL5723882 0.72 OGA (0.52) OGAPARP1TNK2TNK1MAPT
SCHEMBL3435164 0.71 OGA (0.50) OGAPARP1TNK2TNK1MAPT
SCHEMBL15888547 0.71 HRH3 (0.53) OGAPARP1TNK2TNK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312211-A1 Antibacterial Pyrrolopyridines, Pyrrolopyrimidines and Pyrroloazepines-154 ASTRAZENECA AB (SE) 2008-12-18 — — US claimed

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-20080312211-A1 Antibacterial Pyrrolopyridines, Pyrrolopyrimidines and Pyrroloazepines-154 SDHA, QDPR, PNKP OGA 3959/4885PARP1 1138/4885TNK2 2180/4885

“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.

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