SCHEMBL22774158

SCHEMBL22774158

CC(C)(C)[Si](OCc1cc(Br)nc(Br)c1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 2/20 0.32
CYP3A4 P08684 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ABL1 P00519 1/20 0.31
TACR1 P25103 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
SCHEMBL5561672 0.88 IDO1 (0.41) SMYD2CYP3A4HTTSMN1; SMN2ABL1
SCHEMBL31124717 0.84 TRPA1 (0.35) SMYD2CYP3A4HTTSMN1; SMN2TACR1
SCHEMBL2901818 0.84 AR (0.38) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL1314001 0.83 AGXT (0.42) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL501339 0.83 TACR1 (0.32) SMYD2CYP3A4HTTSMN1; SMN2TACR1
SCHEMBL4587307 0.83 IDO1 (0.42) HTTSMN1; SMN2
SCHEMBL6936162 0.82 IDO1 (0.49)
SCHEMBL29910773 0.82 IDO1 (0.49)
SCHEMBL1853659 0.81 AKR1B1 (0.34) CYP3A4HTTSMN1; SMN2TACR1
SCHEMBL31124766 0.81 TSHR (0.35) SMYD2CYP3A4HTTSMN1; SMN2TACR1

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-20220306623-A1 PYRIDYL OR PYRIMIDYL MTOR KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-09-29 US disclosed
EP-3983409-A1 PYRIDYL OR PYRIMIDYL MTOR KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2022-04-20 EP disclosed
CN-114008044-A Pyridyl or pyrimidinyl MTOR kinase inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2022-02-01 CN disclosed
WO-2020249652-A1 PYRIDYL OR PYRIMIDYL MTOR KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-12-17 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-20220306623-A1 PYRIDYL OR PYRIMIDYL MTOR KINASE INHIBITORS MTOR, RICTOR, RPTOR SMYD2 2434/4885CYP3A4 2267/4885HTT 3471/4885

“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.