SCHEMBL5360050

SCHEMBL5360050

CC(C)(C)[Si](C)(C)Oc1ccc(C2CCC(=NCc3ccccc3)CC2)c(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA12 O43570 4/20 0.32
CA1 P00915 4/20 0.32
CA9 Q16790 4/20 0.32
CASP3 P42574 1/20 0.31
CASP7 P55210 1/20 0.31
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 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
SCHEMBL6434922 0.81 CA12 (0.36) CA12CA1CA9HSP90AA1HSP90AB1
SCHEMBL7238042 0.78 HSP90AA1 (0.34) MEN1KMT2ACA12CA1CA9
SCHEMBL5356463 0.77 MEN1 (0.40) MEN1KMT2A
SCHEMBL5362365 0.77 MEN1 (0.40) MEN1KMT2A
SCHEMBL5356460 0.77 MEN1 (0.40) MEN1KMT2A
SCHEMBL6437495 0.77 CA12 (0.38) CA12CA1CA9HSP90AA1HSP90AB1
SCHEMBL6437156 0.77 CA12 (0.38) CA12CA1CA9HSP90AA1HSP90AB1
SCHEMBL5360953 0.77 CA12 (0.44) CA12CA1CA9HSP90AA1HSP90AB1
SCHEMBL6804163 0.74 CA12 (0.40) CA12CA1CA9HSP90AA1HSP90AB1
SCHEMBL6433944 0.73 CA12 (0.39) CA12CA1CA9HSP90AA1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7282592-B2 Resorcinol derivatives WARNER-LAMBERT COMPANY (US) 2007-10-16 US disclosed
US-20070122367-A1 RESORCINOL DERIVATIVES PFIZER INC. (US) 2007-05-31 US disclosed
US-7173052-B2 Resorcinol derivatives PFIZER INC. (US) 2007-02-06 US disclosed
US-20050282899-A1 Resorcinol for lightening skin removing color BRADLEY STUART E 2005-12-22 US disclosed
US-6933319-B2 Resorcinol derivatives PFIZER INC. (US) 2005-08-23 US disclosed
US-6852747-B2 Resorcinol derivatives PFIZER INC. (US) 2005-02-08 US disclosed
US-6828460-B2 Containing at least one ester, oxime, sulfonamide, hydroxyamino or alkyoxyamino functionality; skin lightening agents; tyrosinase inhibitors PFIZER INC. 2004-12-07 US disclosed
EP-1317425-B1 RESORCINOL DERIVATIVES PFIZER PROD INC (US) 2004-11-03 EP disclosed
US-20040209949-A1 Resorcinol derivatives BROWNING ANDREW FRANCIS (SE) 2004-10-21 US disclosed
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-20030180236-A1 Resorcinol derivatives PFIZER PRODUCTS, INC. 2003-09-25 US disclosed
US-6590105-B2 For skin lightening or depigmentation; works by inhibiting tyrosinase in humans; kits WARNER-LAMBERT COMPANY 2003-07-08 US disclosed
US-6541473-B2 Use as skin lightening agents; 4-(1,4-Dioxaspiro(4.5)dec-8-yl)-1,3-benzenediol for example WARNER LAMBERT COMPANY 2003-04-01 US disclosed
US-20020161041-A1 Resorcinol derivatives PFIZER INC. 2002-10-31 US disclosed
US-20020137961-A1 Resorcinol derivatives PFIZER INC. 2002-09-26 US disclosed
US-20020114770-A1 Resorcinol derivatives PFIZER INC. 2002-08-22 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 (8 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-20070122367-A1 RESORCINOL DERIVATIVES LRAT, NQO1, ALDH1A2 MEN1 2440/4885KMT2A 2259/4885CA12 4635/4885
US-20040209949-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 MEN1 2493/4885KMT2A 2172/4885CA12 4452/4885
US-20030190298-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 MEN1 2440/4885KMT2A 2259/4885CA12 4635/4885
US-20030180236-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 MEN1 2440/4885KMT2A 2259/4885CA12 4635/4885
US-20050282899-A1 Resorcinol for lightening skin removing color RBP4, NQO1, ALDH1A2 MEN1 3029/4885KMT2A 771/4885CA12 3704/4885
US-20020161041-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 MEN1 2493/4885KMT2A 2172/4885CA12 4452/4885
US-20020137961-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 MEN1 2440/4885KMT2A 2259/4885CA12 4635/4885
US-20020114770-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 MEN1 2440/4885KMT2A 2259/4885CA12 4635/4885

“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.