SCHEMBL4072199

SCHEMBL4072199

Cc1cc(OCCC(=O)O)cc(C)c1[SiH](C(C)C)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ KDM4E B2RXH2 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ TSHR P16473 2/20 0.39
▸ PPARG P37231 3/20 0.39
▸ PPARD Q03181 3/20 0.39
▸ PPARA Q07869 2/20 0.39
▸ HPGD P15428 1/20 0.38
▸ PTPRB P23467 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ MAPK1 P28482 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
SCHEMBL4070086 0.82 L3MBTL1 (0.56) MCL1L3MBTL1TSHRPPARGPPARD
SCHEMBL4073956 0.79 TP53 (0.41) MCL1L3MBTL1KDM4EPOLBTDP1
SCHEMBL4079485 0.78 TSHR (0.62) L3MBTL1POLBTSHRHPGDLMNA
SCHEMBL15464819 0.77 MCL1 (0.70) MCL1L3MBTL1TSHRHPGDPTPRB
SCHEMBL16503434 0.76 MCL1 (0.68) MCL1L3MBTL1TSHRHPGDPTPRB
SCHEMBL3731595 0.74 L3MBTL1 (0.67) MCL1L3MBTL1POLBTSHRHPGD
SCHEMBL3723832 0.73 L3MBTL1 (0.66) MCL1L3MBTL1POLBTDP1TSHR
SCHEMBL12207085 0.72 MCL1 (0.62) MCL1L3MBTL1POLBTDP1HPGD
SCHEMBL24650387 0.72 MCL1 (0.54) MCL1L3MBTL1
SCHEMBL16480582 0.71 MCL1 (0.69) MCL1L3MBTL1TSHRPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101547933-A Radiofluorination BAYER SCHERING PHARMA AG (DE) 2009-09-30 — — CN disclosed
EP-2074135-A2 SILICON DERIVATIVES FOR PET IMAGING Bayer Schering Pharma AG (DE) 2009-07-01 — — EP disclosed
US-20090035215-A1 RADIOFLUORINATION BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2009-02-05 — — US disclosed
US-20090035215-A1 RADIOFLUORINATION BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2009-02-05 — — US disclosed
WO-2008040441-A2 SILICON DERIVATIVES FOR PET IMAGING BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-04-10 — — 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-20090035215-A1 RADIOFLUORINATION AFF2, AFF1, NUTF2 MCL1 2218/4885L3MBTL1 299/4885KDM4E 2693/4885

“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.

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