SCHEMBL6527128

SCHEMBL6527128

Cc1c(C=O)cccc1CCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.38
▸ DUT P33316 2/20 0.33
▸ KCNJ1 P48048 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ CDK4 P11802 1/20 0.30
▸ CCND1 P24385 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
SCHEMBL31145024 0.87 BACE1 (0.43) BACE1DUTALDH1A1HPGDHTT
SCHEMBL10958983 0.87 BACE1 (0.43) BACE1DUTALDH1A1HPGDHTT
SCHEMBL7754786 0.85 BACE1 (0.37) BACE1DUTALDH1A1HPGDHTT
SCHEMBL1247159 0.85 BACE1 (0.37) BACE1DUTALDH1A1HPGDHTT
SCHEMBL6518418 0.84 CA1 (0.43) BACE1DUTALDH1A1HPGDHTT
SCHEMBL1246807 0.78 DUT (0.33) BACE1DUT
SCHEMBL1244821 0.77 DUT (0.36) BACE1DUTALDH1A1HPGDHTT
SCHEMBL17398862 0.77 ALDH1A1 (0.42) BACE1DUTALDH1A1HPGD
SCHEMBL20121287 0.77 BACE1 (0.35) BACE1DUTALDH1A1HPGDHTT
SCHEMBL17398386 0.75 DUT (0.33) BACE1DUT

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
US-8476265-B2 Compounds-801 ASTRAZENECA AB (SE) 2013-07-02 — — US disclosed
US-8476265-B2 Compounds-801 ASTRAZENECA AB (SE) 2013-07-02 — — US disclosed
US-8476265-B2 Compounds-801 ASTRAZENECA AB (SE) 2013-07-02 — — US disclosed
US-8455483-B2 Compounds—801 ASTRAZENECA AB (SE) 2013-06-04 — — US disclosed
US-8455483-B2 Compounds—801 ASTRAZENECA AB (SE) 2013-06-04 — — US disclosed
US-8455483-B2 Compounds—801 ASTRAZENECA AB (SE) 2013-06-04 — — US disclosed
US-20130018037-A1 Compounds - 801 ASTRAZENECA UK LIMITED (GB) 2013-01-17 — — US disclosed
US-20130018037-A1 Compounds - 801 ASTRAZENECA UK LIMITED (GB) 2013-01-17 — — US disclosed
US-20110053909-A1 Compounds - 801 PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2011-03-03 — — US disclosed
US-20110053909-A1 Compounds - 801 PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2011-03-03 — — US 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-20130018037-A1 Compounds - 801 ADRA2C, ADRB2, ADRB1 BACE1 892/4885DUT 2957/4885KCNJ1 185/4885
US-20110053909-A1 Compounds - 801 ADRA2C, ADRB2, ADRB1 BACE1 892/4885DUT 2957/4885KCNJ1 185/4885

“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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