SCHEMBL3747860

SCHEMBL3747860

Cc1c([Si](C)(C)C)n(C2CCCC2)c2ccc(C(=O)O)cc12

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
HCAR3 P49019 4/20 0.47
GAA P10253 2/20 0.47
HSD17B10 Q99714 2/20 0.47
RAB9A P51151 1/20 0.41
HPD P32754 2/20 0.39
SCN5A Q14524 1/20 0.39
SCN9A Q15858 1/20 0.39
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
TBXAS1 P24557 1/20 0.38
TEAD1 P28347 1/20 0.38
TEAD4 Q15561 1/20 0.38
TEAD2 Q15562 1/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL3752695 0.87 RPS6KB1 (0.49) L3MBTL1GAARAB9AHPDSCN5A
SCHEMBL12051172 0.86 RPS6KB1 (0.48) L3MBTL1GAARAB9ASCN5ASCN9A
SCHEMBL1260412 0.81 L3MBTL1 (0.54) L3MBTL1HCAR3GAAHSD17B10RAB9A
SCHEMBL3744484 0.78 L3MBTL1 (0.49) L3MBTL1HCAR3GAAHSD17B10KDM4E
SCHEMBL5521702 0.77 KCNH2 (0.53) L3MBTL1HCAR3GAAHSD17B10RAB9A
SCHEMBL4726848 0.74 KDM4E (0.58) L3MBTL1HCAR3GAAHSD17B10ALDH1A1
SCHEMBL24016537 0.73 L3MBTL1 (0.51) L3MBTL1HCAR3GAAHSD17B10HPD
SCHEMBL24016110 0.72 L3MBTL1 (0.53) L3MBTL1HCAR3GAAHSD17B10SCN5A
SCHEMBL9613233 0.72 L3MBTL1 (1.00) L3MBTL1HCAR3GAAHSD17B10ALDH1A1
SCHEMBL1260664 0.70 L3MBTL1 (0.47) L3MBTL1HCAR3GAAHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7838537-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-11-23 US disclosed
EP-1587585-B1 ACYLSULFONAMIDE COMPOUNDS AS INHIBITORS OF RNA-DEPENDENT RNA (VIRAL) POLYMERASES BOEHRINGER INGELHEIM INT (DE) 2008-10-15 EP disclosed
US-20080119490-A1 Viral Polymerase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-05-22 US disclosed
US-7323470-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-01-29 US disclosed
US-7098231-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-08-29 US disclosed
US-20060189672-A1 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-08-24 US disclosed
EP-1587585-A1 ACYLSULFONAMIDE COMPOUNDS AS INHIBITORS OF RNA-DEPENDENT RNA (VIRAL) POLYMERASES Boehringer Ingelheim International GmbH (DE) 2005-10-26 EP disclosed
US-20040186125-A1 E.g , 3-cyclohexyl-2-furan-3-yl-1Hindole-5-carboxylic acid; hepatitis C viricides that target RNA dependent RNA polymerases (Ns5B) in mammals, an enzyme essential to viral replication; used in conjunction with an mmunomodulatory agent, such as beta -, delta - gamma -, and omega -interferon BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-09-23 US disclosed
WO-2004064925-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-08-05 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 (3 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-20060189672-A1 Viral polymerase inhibitors POLM, POLR2A, POLR2H L3MBTL1 117/4885HCAR3 4880/4885GAA 776/4885
US-20080119490-A1 Viral Polymerase Inhibitors POLM, POLR2H, POLR2A L3MBTL1 584/4885HCAR3 4877/4885GAA 994/4885
US-20040186125-A1 E.g , 3-cyclohexyl-2-furan-3-yl-1Hindole-5-carboxylic acid; hepatitis C viricides that target RNA dependent RNA polymerases (Ns5B) in mammals, an enzyme essential to viral replication; used in conjunction with an mmunomodulatory agent, such as beta -, delta - gamma -, and omega -interferon IFNAR1, IFNG, EIF2AK2 L3MBTL1 2103/4885HCAR3 4525/4885GAA 1082/4885

“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.