SCHEMBL6434856

SCHEMBL6434856

COCOc1ccc(C2CCC(c3ccc(O[SiH](C)C)cc3)CC2)c(OCOC)c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ROR1 Q01973 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.32
NPY1R P25929 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CYP19A1 P11511 1/20 0.32
DRD2 P14416 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
SCHEMBL6439221 0.79 ROR1 (0.36) ROR1MRGPRX4CYP19A1
SCHEMBL6434923 0.78 ROR1 (0.36) ROR1NPY1RSLC6A2SLC6A4SLC6A3
SCHEMBL6437544 0.77 ROR1 (0.33) ROR1SLC6A4CYP19A1
SCHEMBL613626 0.77 ROR1 (0.36) ROR1NPY1RSLC6A2SLC6A4SLC6A3
SCHEMBL6433053 0.76 ROR1 (0.40) ROR1NPY1RCYP19A1
SCHEMBL2133033 0.75 DRD2 (0.44) MRGPRX4SLC6A2SLC6A4SLC6A3DRD2
SCHEMBL6485919 0.73 FFAR4 (0.41)
SCHEMBL6433135 0.72 PDE10A (0.39) ROR1NPY1RCYP19A1
SCHEMBL6438560 0.71 ROR1 (0.41) ROR1CYP19A1
SCHEMBL615753 0.70 ROR1 (0.37) ROR1CYP19A1

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
EP-1165495-B1 RESORCINOL DERIVATIVES PFIZER (US) 2005-04-20 EP 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
US-20020161041-A1 Resorcinol derivatives PFIZER INC. 2002-10-31 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 (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-20020161041-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 ROR1 472/4885MRGPRX4 1001/4885NPY1R 4089/4885

“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.