SCHEMBL8286245

SCHEMBL8286245

Cc1nc2c(nc1C)C(n1c(N)nc3cc(CO)ccc31)CCC2

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PRKACA P17612 3/20 0.45
▸ RPS6KB1 P23443 2/20 0.45
▸ RPS6KA5 O75582 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ GFER P55789 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ MTOR P42345 1/20 0.32
▸ CYP19A1 P11511 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ GSK3B P49841 2/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ NUDT1 P36639 1/20 0.30
▸ BACE1 P56817 1/20 0.30
▸ IDH1 O75874 2/20 0.30
▸ ROCK1 Q13464 1/20 0.30

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
SCHEMBL8286249 0.92 PRKACA (0.36) PRKACARPS6KB1RPS6KA5MTORCYP19A1
SCHEMBL8285691 0.81 ALDH1A1 (0.34) PRKACARPS6KB1KDM4EALDH1A1MAPT
SCHEMBL8286244 0.81 RPS6KB1 (0.42) RPS6KB1KDM4EALDH1A1MAPTCYP19A1
SCHEMBL8284441 0.76 TRPC5 (0.42) KDM4EALDH1A1HSD17B10
SCHEMBL8285554 0.75 ALDH1A3 (0.31) ALDH1A1
SCHEMBL2027616 0.74 PRKACA (0.60) PRKACARPS6KB1RPS6KA5KDM4EALDH1A1
SCHEMBL2033562 0.70 PRKACA (0.53) PRKACARPS6KB1RPS6KA5KDM4EALDH1A1
SCHEMBL2033557 0.70 PRKACA (0.53) PRKACARPS6KB1RPS6KA5KDM4EALDH1A1
SCHEMBL4565790 0.69 PRKACA (0.54) PRKACARPS6KB1RPS6KA5KDM4EALDH1A1
SCHEMBL8284443 0.69 BCHE (0.40) KDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044073-B2 Aminobenzimidazoles and benzimidazoles as inhibitors of respiratory syncytial virus replication TIBOTEC PHARMACEUTICALS (IE) 2011-10-25 — — US disclosed
US-8044073-B2 Aminobenzimidazoles and benzimidazoles as inhibitors of respiratory syncytial virus replication TIBOTEC PHARMACEUTICALS (IE) 2011-10-25 — — US disclosed
US-20070099924-A1 Aminobenzimidazoles and benzimidazoles as inhibitors of respiratory syncytial virus replication JANSSEN SCIENCES IRELAND UC (IE) 2007-05-03 — — US disclosed
US-20070099924-A1 Aminobenzimidazoles and benzimidazoles as inhibitors of respiratory syncytial virus replication JANSSEN SCIENCES IRELAND UC (IE) 2007-05-03 — — US disclosed
WO-2005058869-A1 AMINOBENZIMIDAZOLES AND BENZIMIDAZOLES AS INHIBITORS OF RESPIRATORY SYNCYTIAL VIRUS REPLICATION TIBOTEC PHARMACEUTICALS LTD. (IE) 2005-06-30 — — 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-20070099924-A1 Aminobenzimidazoles and benzimidazoles as inhibitors of respiratory syncytial virus replication H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, H1-2, H1-4 PRKACA 4682/4885RPS6KB1 1098/4885RPS6KA5 2308/4885

“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.

Send feedback