SCHEMBL5486814

SCHEMBL5486814

COC(=O)Cc1cc(OC)c(OC)cc1C(=O)c1cccc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.53
CNR1 P21554 4/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
GAA P10253 1/20 0.51
POLB P06746 1/20 0.49
KMT2A Q03164 1/20 0.49
CDC25B P30305 1/20 0.47
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
AKR1C2 P52895 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
CASP3 P42574 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL5486180 0.80 CASP3 (0.58) GAAPOLBKMT2ACASP3SENP6
SCHEMBL5490326 0.78 CDC25B (0.50) CNR2CNR1L3MBTL1GAAKMT2A
SCHEMBL5492931 0.77 NAMPT (0.50) CNR2CNR1POLBKMT2ACASP3
SCHEMBL9856908 0.76 CDC25B (0.59) CNR2CNR1GAAPOLBKMT2A
SCHEMBL6612456 0.75 TNFSF11 (0.49) CNR2CNR1POLBCDC25BAKR1C2
SCHEMBL709403 0.75 L3MBTL1 (0.68) L3MBTL1KMT2ATDP1KDM4ECYP1A2
SCHEMBL29503119 0.75 L3MBTL1 (0.68) L3MBTL1KMT2ATDP1KDM4ECYP1A2
SCHEMBL197773 0.73 HTT (0.53) GAAKDM4ECYP3A4
SCHEMBL11800712 0.73 KDM4E (0.54) L3MBTL1GAAPOLBKMT2AKDM4E
SCHEMBL28044180 0.73 L3MBTL1 (0.66) L3MBTL1KMT2ATDP1KDM4ECYP1A2

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
WO-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO claimed
US-7250410-B2 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof VIA PHARMACEUTICALS, INC. (US) 2007-07-31 US disclosed
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof BAY CITY CAPITAL LLC 2004-08-05 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-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof PDE7A, PDE3B, PDE3A CNR2 139/4885CNR1 101/4885L3MBTL1 4834/4885

“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.