SCHEMBL16201550

SCHEMBL16201550

COc1ccc(C(=O)Nc2ccccc2C(=O)Nc2nc3ccccc3n2C)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.79
PDE10A Q9Y233 1/20 0.79
MAPT P10636 3/20 0.64
KDM4E B2RXH2 3/20 0.64
HSD17B10 Q99714 3/20 0.64
TSHR P16473 2/20 0.64
HTT P42858 2/20 0.64
LMNA P02545 1/20 0.64
NPC1 O15118 10/20 0.62
RAB9A P51151 9/20 0.62
TP53 P04637 4/20 0.62
ALDH1A1 P00352 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
GAA P10253 1/20 0.62
HPGD P15428 1/20 0.62
MAPK1 P28482 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
IRAK4 Q9NWZ3 1/20 0.61
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59

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
SCHEMBL14998929 0.89 PDE11A (1.00) PDE11APDE10AMAPTKDM4EHSD17B10
SCHEMBL16201551 0.88 PDE11A (0.84) PDE11APDE10AMAPTKDM4EHSD17B10
SCHEMBL29510945 0.78 RAB9A (1.00) PDE11APDE10AMAPTKDM4EHSD17B10
SCHEMBL14773948 0.78 RAB9A (1.00) PDE11APDE10AMAPTKDM4EHSD17B10
SCHEMBL3604861 0.77 IRAK4 (0.80) MAPTKDM4EHSD17B10TSHRHTT
SCHEMBL14855681 0.77 F10 (0.72) MAPTHTTNPC1RAB9AALDH1A1
SCHEMBL17916715 0.76 RAB9A (0.89) PDE11APDE10AMAPTKDM4EHSD17B10
SCHEMBL29870324 0.76 F10 (0.70) MAPTKDM4ENPC1RAB9ATP53
SCHEMBL21528226 0.76 F10 (0.70) MAPTKDM4ENPC1RAB9ATP53
SCHEMBL21105717 0.76 IRAK4 (1.00) MAPTKDM4EHSD17B10TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9173884-B2 Inhibitors of phosphodiesterase 11 (PDE11) TRUSTEES OF BOSTON COLLEGE (US) 2015-11-03 US disclosed
US-20140323503-A1 INHIBITORS OF PHOSPODIESTERASES 11 (PDE11) AND METHODS OF USE TO ELEVATE CORTISOL PRODUCTION TRUSTEES OF BOSTON COLLEGE 2014-10-30 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-20140323503-A1 INHIBITORS OF PHOSPODIESTERASES 11 (PDE11) AND METHODS OF USE TO ELEVATE CORTISOL PRODUCTION PDE12, HSD11B2, PDE7A PDE11A 24/4885PDE10A 12/4885MAPT 3307/4885

“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.