SCHEMBL6806304

SCHEMBL6806304

CC(=O)OC1(OC(C)=O)CCC(c2ccc(O[Si](C)(C)C(C)(C)C)cc2O[Si](C)(C)C(C)(C)C)CC1C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PREP P48147 3/20 0.35
CA12 O43570 4/20 0.33
CA1 P00915 4/20 0.33
CA9 Q16790 4/20 0.33
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32

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
SCHEMBL6499014 0.76 CA12 (0.38) PREPCA12CA1CA9HSP90AA1
SCHEMBL6434920 0.76 CA12 (0.37) PREPCA12CA1CA9HSP90AA1
SCHEMBL6433055 0.75 CA12 (0.37) PREPCA12CA1CA9HSP90AA1
SCHEMBL6433061 0.75 CA12 (0.37) PREPCA12CA1CA9HSP90AA1
SCHEMBL7701156 0.73 DRD2 (0.33) PREPCA12CA1CA9HSP90AA1
SCHEMBL6434340 0.73 CA12 (0.39) PREPCA12CA1CA9HSP90AA1
SCHEMBL5619277 0.73 TYR (0.38) HSP90AA1
SCHEMBL6435288 0.73 MTNR1A (0.37) PREPCA12CA1CA9HSP90AA1
SCHEMBL6433452 0.73 MTNR1A (0.37) PREPCA12CA1CA9HSP90AA1
SCHEMBL6433944 0.72 CA12 (0.39) PREPCA12CA1CA9HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6797731-B2 USE AS SKIN LIGHTENING AGENTS PFIZER INC. 2004-09-28 US disclosed
US-20030190298-A1 Resorcinol derivatives BRADLEY STUART E (GB) 2003-10-09 US disclosed
US-20020137961-A1 Resorcinol derivatives PFIZER INC. 2002-09-26 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-20030190298-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 PREP 1379/4885CA12 4635/4885CA1 4874/4885
US-20020137961-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 PREP 1379/4885CA12 4635/4885CA1 4874/4885

“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.