SCHEMBL9944401

SCHEMBL9944401

Cc1cc(-[s+]2c3ccccc3c3ccccc32)cc(C)c1OCC(=O)OC1(C)C(C)CC2CCCC1C2

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
OPRM1 P35372 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
SCHEMBL98174 0.86 CYP17A1 (0.41) MMP1MMP9MMP8
Hydrochloric Acid SCHEMBL31108770 0.85 CYP17A1 (0.42) MMP1MMP9MMP8
SCHEMBL30029852 0.75 MMP1 (0.35) MMP1MMP9MMP8
SCHEMBL13305184 0.74 NPSR1 (0.41) MMP1MMP9MMP8
Bromide SCHEMBL30996178 0.74 MMP1 (0.34) MMP1MMP9MMP8
SCHEMBL25740714 0.73 NPSR1 (0.30) OPRM1
SCHEMBL25689778 0.67 CYP17A1 (0.42) MMP1MMP9MMP8
SCHEMBL25595294 0.67 CYP17A1 (0.44)
SCHEMBL25468324 0.66 CYP17A1 (0.43) MMP1MMP9MMP8
SCHEMBL22821191 0.66 CYP17A1 (0.43) MMP1MMP9MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120148955-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, AND NEW COMPOUND TOKYO OHKA KOGYO CO., LTD. (JP) 2012-06-14 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-20120148955-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, AND NEW COMPOUND C1R, SLC11A2, RER1 MMP1 2707/4885MMP9 3095/4885MMP8 1803/4885

“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.