SCHEMBL6795155

SCHEMBL6795155

C#CCC(CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SMYD2 Q9NRG4 2/20 0.32

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
SCHEMBL23856894 0.89 CYP3A4 (0.32) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL9886683 0.87 CYP3A4 (0.31) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL15300042 0.81 SMYD2 (0.31) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL30897924 0.80 SMYD2 (0.35) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL12621518 0.80 SMYD2 (0.35) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL14999549 0.80 SMYD2 (0.35) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL31382508 0.80 CYP3A4 (0.37) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL2456643 0.79 SMYD2 (0.36) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL9468800 0.79 CYP3A4 (0.33) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL9468934 0.79 CYP3A4 (0.33) CYP3A4HTTSMN1; SMN2SMYD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727248-B2 N-(4-CHLOROBENZYL)-8-(3-HYDROXY-1-PROPYNYL)-1-METHYL-6-(4 -MORPHOLINYLMETHYL)-4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDE, FOR TREATING INFECTIONS BY HERPES VIRUSES PHARMACIA & UPJOHN COMPANY 2004-04-27 US disclosed
EP-1363887-A1 SUBSTITUTED QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-11-26 EP disclosed
US-20030149035-A1 Substituted quinolinecarboxamides as antiviral agents VAILLANCOURT VALERIE A (US) 2003-08-07 US disclosed
US-6544990-B2 Substituted quinolinecarboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2003-04-08 US disclosed
US-20020165253-A1 Substituted quinolinecarboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-11-07 US disclosed
WO-2002070487-A1 SUBSTITUTED QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2002-09-12 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 (2 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-20030149035-A1 Substituted quinolinecarboxamides as antiviral agents ZC3HAV1, IRF3, EIF2AK2 CYP3A4 808/4885HTT 3670/4885SMN1; SMN2 4349/4885
US-20020165253-A1 Substituted quinolinecarboxamides as antiviral agents ZC3HAV1, IRF3, EIF2AK2 CYP3A4 808/4885HTT 3670/4885SMN1; SMN2 4349/4885

“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.