SCHEMBL9364993

SCHEMBL9364993

C[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.34
CYP1A2 P05177 1/20 0.34
BTN3A1 O00481 1/20 0.31
ALDH1A1 P00352 1/20 0.31
FOLH1 Q04609 2/20 0.31
NAALAD2 Q9Y3Q0 2/20 0.31
ENPEP Q07075 2/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL5027923 1.00 GABRR1 (0.34) GABRR1CYP1A2BTN3A1ALDH1A1FOLH1
SCHEMBL5027924 1.00 GABRR1 (0.34) GABRR1CYP1A2BTN3A1ALDH1A1FOLH1
SCHEMBL16840474 0.84 TSHR (0.31) BTN3A1
SCHEMBL26478528 0.82
SCHEMBL30664718 0.82
SCHEMBL12858172 0.81 GABRR1 (0.41) GABRR1CYP1A2BLM
SCHEMBL1751319 0.81 BTN3A1 (0.35) BTN3A1
SCHEMBL2670209 0.81 BTN3A1 (0.35) BTN3A1
SCHEMBL2670343 0.81 BTN3A1 (0.35) BTN3A1
SCHEMBL2719334 0.80 PGK1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117917416-A KRAS G12D degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2024-04-23 CN disclosed
CN-117917410-A Pan-KRAS degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2024-04-23 CN disclosed
US-20230133817-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2023-05-04 US disclosed
EP-0229384-B1 Beta-lactam compounds and their production SUMITOMO PHARMA (JP) 1994-08-10 EP disclosed
US-5134231-A Chemical intermediates for 1-alkylcarbapenem compounds SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1992-07-28 US disclosed
US-4892961-A Amino acid derivatives, and their production SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-01-09 US disclosed
EP-0210657-B1 AMINO ACID DERIVATIVES, AND THEIR PRODUCTION SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1989-05-03 EP disclosed
WO-1988001619-A1 1'-METHYL-BETA-LACTAM COMPOUNDS AND THEIR PRODUCTION SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1988-03-10 WO disclosed
EP-0229384-A2 Beta-lactam compounds and their production SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-07-22 EP disclosed
EP-0210657-A1 Amino acid derivatives, and their production SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-02-04 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 (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-20230133817-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS MRPL21, PEPD, CTSC GABRR1 4017/4885CYP1A2 4095/4885BTN3A1 3059/4885

“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.