SCHEMBL8285100

SCHEMBL8285100

Cc1cc(C)c2nc(NC3CCN(C4OC(C)O4)CC3)n(Cc3nc(C)ccc3O)c2c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 3/20 0.33
▸ SOS1 Q07889 1/20 0.31
▸ NR4A2 P43354 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ SSTR5 P35346 1/20 0.30
▸ GPR6 P46095 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
SCHEMBL8287095 0.89 SSTR5 (0.36) PDE5ASOS1NR4A2KCNH2SSTR5
SCHEMBL8285105 0.86 PDE5A (0.37) PDE5ASOS1NR4A2KCNH2SSTR5
SCHEMBL8285108 0.84 KCNH2 (0.38) NR4A2KCNH2SSTR5
SCHEMBL1495211 0.84 KCNH2 (0.39) PDE5ANR4A2KCNH2SSTR5
SCHEMBL8285106 0.83 SOS1 (0.45) PDE5ASOS1NR4A2KCNH2
SCHEMBL1495304 0.82 KCNH2 (0.38) PDE5ANR4A2KCNH2SSTR5
SCHEMBL8285822 0.82 PDE4B (0.38) NR4A2KCNH2SSTR5
SCHEMBL14002666 0.82 NOS2 (0.46) —
SCHEMBL8285811 0.82 KCNH2 (0.39) PDE5ASOS1NR4A2KCNH2SSTR5
SCHEMBL1495198 0.80 KCNH2 (0.36) PDE5ANR4A2KCNH2SSTR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280881-A1 MORPHOLINYL CONTAINING BENZIMIDAZOLES AS INHIBITORS OF RESPIRATORY SYNCYTIAL VIRUS REPLICATION JANSSEN SCIENCES IRELAND UC (IE) 2008-11-13 — — US disclosed
US-7449463-B2 2-[6-{[2-(3-Hydroxy-propyl)-5-methyl-phenylamino]-methyl}-2-(3-morpholin-4-yl-propylamino)-benzimidazol-1-ylmethyl]-6-methyl-pyridin-3-ol, or its N-oxide, salt, quaternary amine, or metal complex; optionally with an additional antiviral agent TIBOTEC PHARMACEUTICALS LTD. (IE) 2008-11-11 — — US disclosed
US-7355051-B2 Piperdine-amino-benzimidazole derivatives as inhibitors of respiratory syncytial virus replication TIBOTEC PHARMACEUTICALS (IE) 2008-04-08 — — US disclosed
WO-2005058871-A1 MORPHOLINYL CONTAINING 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-20080280881-A1 MORPHOLINYL CONTAINING BENZIMIDAZOLES AS INHIBITORS OF RESPIRATORY SYNCYTIAL VIRUS REPLICATION RIN1, ZC3HAV1L, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 PDE5A 4430/4885SOS1 1526/4885NR4A2 99/4885

“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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