SCHEMBL275937

SCHEMBL275937

COc1ccc([Si](C)(C)C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.61
CA2 P00918 2/20 0.61
CA7 P43166 2/20 0.61
CA9 Q16790 2/20 0.61
CA12 O43570 1/20 0.61
CA14 Q9ULX7 1/20 0.61
ACHE P22303 1/20 0.50
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 3/20 0.48
MAPK1 P28482 2/20 0.48
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
RECQL P46063 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL915383 0.87 MAPT (0.71) CA1CA2CA7CA9CA12
SCHEMBL13241216 0.85 KDM4E (0.46) CA1CA2CA7CA9CA12
SCHEMBL19862402 0.83 CA1 (0.61) CA1CA2CA7CA9CA12
SCHEMBL13940041 0.83 CA1 (0.42) CA1CA2CA7CA9CA12
SCHEMBL9563117 0.83 RXFP1 (0.61) CA1CA2ALDH1A1MEN1KMT2A
SCHEMBL13338782 0.80 EGFR (0.47) CA1CA2CA7CA9CA12
SCHEMBL10996654 0.80 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ATDP1MAPK1
SCHEMBL2544548 0.80 CA1 (0.65) CA1CA2CA7CA9CA12
SCHEMBL275936 0.79 CA1 (0.55) CA1CA2CA7CA9CA12
SCHEMBL2176392 0.79 CA1 (0.55) CA1CA2CA7CA9CA12

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 78 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116063063-B Erosion-resistant shaping refractory material and preparation method thereof 大城县宏大高温材料有限公司 2023-09-05 CN claimed
CN-116063063-A Erosion-resistant shaping refractory material and preparation method thereof 大城县宏大高温材料有限公司 2023-05-05 CN claimed
US-11827638-B2 Imidazopyrrolopyridine as inhibitors of the JAK family of kinases JANSSEN PHARMACEUTICA NV (BE) 2023-11-28 US disclosed
CN-116063063-B Erosion-resistant shaping refractory material and preparation method thereof 大城县宏大高温材料有限公司 2023-09-05 CN disclosed
CN-116063063-B Erosion-resistant shaping refractory material and preparation method thereof 大城县宏大高温材料有限公司 2023-09-05 CN disclosed
CN-116444483-A Preparation method of 1,3-dithiane substituted diene derivative 兰州大学 2023-07-18 CN disclosed
CN-116063063-A Erosion-resistant shaping refractory material and preparation method thereof 大城县宏大高温材料有限公司 2023-05-05 CN disclosed
CN-116063063-A Erosion-resistant shaping refractory material and preparation method thereof 大城县宏大高温材料有限公司 2023-05-05 CN disclosed
EP-3555096-B1 IMIDAZOPYRROLOPYRIDINE AS INHIBITORS OF THE JAK FAMILY OF KINASES JANSSEN PHARMACEUTICA NV (BE) 2022-11-23 EP disclosed
CN-114685505-A Imidazopyrrolopyridines as JAK family kinase inhibitors 詹森药业有限公司 2022-07-01 CN disclosed
CN-110312719-B Imidazopyrrolopyridines as JAK family kinase inhibitors 詹森药业有限公司 2022-04-15 CN disclosed
US-7074523-B2 Lithium secondary battery HITACHI, LTD. (JP) 2006-07-11 US disclosed
WO-2005044825-A1 SILICON COMPOUNDS AND THEIR USE AMEDIS PHARMACEUTICALS LTD. (GB) 2005-05-19 WO disclosed
US-6852717-B2 Compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-02-08 US disclosed
US-20040106039-A1 nonaqueous electrolytic solution containing a compound that is oxidized at a voltage > a charge end voltage of the battery and a compound which inhibits reactions at voltages < the charge end voltage ARAI JUICHI (JP) 2004-06-03 US disclosed
EP-1392661-A1 DIARYLUREA DERIVATIVES USEFUL AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2004-03-03 EP disclosed
US-20030008868-A1 Compounds useful as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2003-01-09 US disclosed
US-20030003370-A1 Nonaqueous electrolytic solution containing a compound which is oxidized at a voltage higher than a charge end voltage of the lithium secondary battery and a compound which inhibits reactions at voltages lower than said charge end voltage. HITACHI, LTD. (JP) 2003-01-02 US disclosed
WO-2002092576-A1 DIARYLUREA DERIVATIVES USEFUL AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2002-11-21 WO disclosed
EP-1258939-A2 Lithium secondary battery Hitachi, Ltd. (JP) 2002-11-20 EP 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-11827638-B2 Imidazopyrrolopyridine as inhibitors of the JAK family of kinases JAK1, JAK2, JAK3 CA1 4821/4885CA2 4070/4885CA7 4853/4885
US-20030008868-A1 Compounds useful as anti-inflammatory agents TNF, MPO, PTGES CA1 4107/4885CA2 4104/4885CA7 4144/4885

“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.