SCHEMBL1660157

SCHEMBL1660157

C/C=C1/CCc2c(O)cccc21

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.51
CYP19A1 P11511 5/20 0.48
PARP1 P09874 1/20 0.43
EGFR P00533 1/20 0.39
BCL2L1 Q07817 1/20 0.38
BAD Q92934 1/20 0.38
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
MIF P14174 1/20 0.35
TNF P01375 1/20 0.35
TYR P14679 1/20 0.35
TRPA1 O75762 1/20 0.34

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
SCHEMBL1660159 1.00 MAOB (0.51) MAOBCYP19A1PARP1EGFRBCL2L1
SCHEMBL12563341 1.00 MAOB (0.51) MAOBCYP19A1PARP1EGFRBCL2L1
SCHEMBL389461 0.69 PARP1 (0.56) MAOBCYP19A1PARP1BCL2L1BAD
SCHEMBL1658784 0.69 PARP1 (0.47) MAOBCYP19A1PARP1EGFRBCL2L1
SCHEMBL29392687 0.69 PARP1 (0.56) MAOBCYP19A1PARP1BCL2L1BAD
SCHEMBL7989187 0.69 MAOB (0.67) MAOBCYP19A1PARP1MIFTNF
SCHEMBL122969 0.68 BCL2L1 (0.50) MAOBCYP19A1PARP1BCL2L1BAD
SCHEMBL7253403 0.68 BCL2L1 (0.42) MAOBCYP19A1PARP1BCL2L1BAD
SCHEMBL7253406 0.68 BCL2L1 (0.42) MAOBCYP19A1PARP1BCL2L1BAD
SCHEMBL636342 0.67 CYP19A1 (0.52) MAOBCYP19A1PARP1CYP11B1CYP11B2

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
EP-2307394-B1 SULPHONAMIDES AS VANILLOID RECEPTOR ANTAGONIST AMOREPACIFIC CORP (KR) 2012-09-26 EP disclosed
US-20110152318-A1 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AMOREPACIFIC CORPORATION (KR) 2011-06-23 US disclosed
EP-2307394-A2 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Amorepacific Corporation (KR) 2011-04-13 EP disclosed
WO-2010002209-A2 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AMOREPACIFIC CORPORATION (KR) 2010-01-07 WO 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-20110152318-A1 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME TRPV1, TRPA1, TRPV2 MAOB 2733/4885CYP19A1 2959/4885PARP1 2857/4885

“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.