SCHEMBL6220202

SCHEMBL6220202

COC(=O)c1ccc2c(c1)nc(CCl)n2CCC(C)C

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 14/20 0.67
▸ KDM4E B2RXH2 1/20 0.54
▸ BCHE P06276 10/20 0.52
▸ ACHE P22303 2/20 0.52
▸ CNR1 P21554 6/20 0.50
▸ OPRM1 P35372 1/20 0.50

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
SCHEMBL6216920 0.90 CNR2 (0.68) CNR2KDM4EBCHEACHECNR1
SCHEMBL3729395 0.78 CNR2 (0.48) CNR2BCHEACHECNR1OPRM1
Hydrochloric Acid SCHEMBL17416412 0.77 CNR2 (0.47) CNR2BCHEACHECNR1OPRM1
SCHEMBL26046966 0.77 KDM4E (0.51) CNR2KDM4E
SCHEMBL26039133 0.77 KDM4E (0.51) CNR2KDM4E
SCHEMBL24306324 0.77 KDM4E (0.51) CNR2KDM4E
SCHEMBL7745377 0.77 TSHR (0.50) CNR2BCHEACHE
SCHEMBL6244917 0.77 TSHR (0.50) CNR2BCHEACHECNR1OPRM1
SCHEMBL20280108 0.77 TLR7 (0.48) CNR2KDM4E
SCHEMBL29559474 0.77 TLR7 (0.48) CNR2KDM4E

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-6919331-B2 Substituted 2-methyl-benzimidazole respiratory syncytial virus antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2005-07-19 — — US disclosed
EP-1461035-A4 SUBSTITUTED 2-METHYL-BENZIMIDAZOLE RESPIRATORY SYNCYTIAL VIRUS ANTIVIRAL AGENTS BRISTOL MYERS SQUIBB CO (US) 2005-04-06 — — EP disclosed
EP-1461035-A2 SUBSTITUTED 2-METHYL-BENZIMIDAZOLE RESPIRATORY SYNCYTIAL VIRUS ANTIVIRAL AGENTS Bristol-Myers Squibb Company (US) 2004-09-29 — — EP disclosed
US-20030207868-A1 Substituted 2-methyl-benzimidazole respiratory syncytial virus antiviral agents BRISTOL-MYERS SQUIBB COMPANY 2003-11-06 — — US disclosed
WO-2003053344-A2 SUBSTITUTED 2-METHYL-BENZIMIDAZOLE RESPIRATORY SYNCYTIAL VIRUS ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-07-03 — — 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-20030207868-A1 Substituted 2-methyl-benzimidazole respiratory syncytial virus antiviral agents MAVS, ZC3HAV1, EIF2AK2 CNR2 4156/4885KDM4E 335/4885BCHE 3508/4885

“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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