SCHEMBL6485121

SCHEMBL6485121

COCOc1ccc(C2CCCC(C(=O)NO)C2)c(OCOC)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.35
ALOX15 P16050 1/20 0.35
PTGDR Q13258 1/20 0.35
MTNR1A P48039 5/20 0.35
HDAC8 Q9BY41 1/20 0.34
MTNR1B P49286 4/20 0.34
HPGD P15428 1/20 0.34
NQO2 P16083 1/20 0.34
ADAM17 P78536 1/20 0.34
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33

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
SCHEMBL6434817 0.89 MTNR1A (0.40) POLBMAPK1SMN1; SMN2ALDH1A1MTNR1A
SCHEMBL6437950 0.88 PTGDR2 (0.40) POLBPTGDR2ALDH1A1ALOX15PTGDR
SCHEMBL6435769 0.87 PARP15 (0.38) POLBPTGDR2SMN1; SMN2ALDH1A1ALOX15
SCHEMBL6434910 0.82 CNR2 (0.33) PTGDR2SMN1; SMN2PTGDR
SCHEMBL6434913 0.82 CNR2 (0.33) PTGDR2SMN1; SMN2PTGDR
SCHEMBL6434919 0.82 CNR2 (0.33) PTGDR2SMN1; SMN2PTGDR
SCHEMBL6437898 0.80 MTNR1A (0.41) PTGDR2SMN1; SMN2ALDH1A1MTNR1AMTNR1B
SCHEMBL6437915 0.78 PARP15 (0.36) PTGDR2PTGDR
SCHEMBL6434678 0.78 ADORA2A (0.35) PTGDR2MAPK1ALDH1A1ALOX15
SCHEMBL6433478 0.76 GLA (0.35) PTGDR2ALDH1A1HPGDMMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6933319-B2 Resorcinol derivatives PFIZER INC. (US) 2005-08-23 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
US-20040209949-A1 Resorcinol derivatives BROWNING ANDREW FRANCIS (SE) 2004-10-21 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 (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-20040209949-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 POLB 2696/4885PTGDR2 3263/4885MAPK1 4085/4885
US-20020161041-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 POLB 2696/4885PTGDR2 3263/4885MAPK1 4085/4885

“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.