SCHEMBL317589

SCHEMBL317589

CC1(c2ccccc2)C(=O)Cc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
HTR2A P28223 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP1A2 P05177 1/20 0.40
ALDH1A1 P00352 2/20 0.38
SIGMAR1 Q99720 1/20 0.37
CYP2A6 P11509 1/20 0.35
CFTR P13569 1/20 0.34
GOPC Q9HD26 1/20 0.34
LMNA P02545 1/20 0.34
KDM1A O60341 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
GSK3A P49840 2/20 0.34
GSK3B P49841 1/20 0.34
AHR P35869 1/20 0.33
PDK2 Q15119 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
SCHEMBL317588 1.00 MMP2 (0.44) MMP2MMP9HTR2AMEN1KMT2A
SCHEMBL3284760 0.80 MMP2 (0.54) MMP2MMP9MEN1KMT2ACYP1A2
SCHEMBL24524512 0.77 LMNA (0.44) HTR2AMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL5740020 0.76 HTR2A (0.48) HTR2AMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL7117159 0.75 HTR2A (0.38) HTR2AMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL6070424 0.73 ALDH1A1 (0.43) HTR2AMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL15490742 0.70 HTR2A (0.43) HTR2AMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL2627033 0.68 CYP1A2 (0.46) HTR2AKMT2ACYP1A2ALDH1A1CYP2A6
SCHEMBL12409767 0.68 HTR2A (0.40) HTR2AMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL15490617 0.68 HTR2A (0.40) HTR2AMEN1KMT2ACYP1A2ALDH1A1

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-2045014-B1 POLYMER-SUPPORTED METAL COMPLEX CATALYST UNIV HOKKAIDO NAT UNIV CORP (JP) 2014-01-15 EP disclosed
US-8092720-B2 Polymer-supported metal complex catalyst NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2012-01-10 US disclosed
US-20090227743-A1 POLYMER-SUPPORTED METAL COMPLEX CATALYST NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2009-09-10 US disclosed
EP-2045014-A1 POLYMER-SUPPORTED METAL COMPLEX CATALYST National University Corporation Hokkaido University (JP) 2009-04-08 EP 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-20090227743-A1 POLYMER-SUPPORTED METAL COMPLEX CATALYST PYM1, ARG1, SCO2 MMP2 3795/4885MMP9 3831/4885HTR2A 4459/4885

“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.