SCHEMBL3084200

SCHEMBL3084200

C[C@H]1[C@H](NC(=O)OC(C)(C)C)CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PREP P48147 3/20 0.47
TSHR P16473 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
ACE2 Q9BYF1 1/20 0.46
CTSK P43235 1/20 0.46
KLK7 P49862 1/20 0.46
GFER P55789 1/20 0.46
CTSL P07711 1/20 0.46
CTRB1 P17538 1/20 0.46
ALDH1A1 P00352 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
SCHEMBL29187943 1.00 PDE4B (0.49) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL3070355 1.00 PDE4B (0.49) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL3084195 1.00 PDE4B (0.49) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL3070357 1.00 PDE4B (0.49) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL3070354 1.00 PDE4B (0.49) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL16032213 0.92 KLK7 (0.48) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL16030781 0.92 KLK7 (0.48) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL16030780 0.92 KLK7 (0.48) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL16031358 0.92 KLK7 (0.48) PDE4BL3MBTL1KMT2ANPSR1PREP
SCHEMBL23971172 0.89 L3MBTL1 (0.49) PDE4BL3MBTL1KMT2ANPSR1PREP

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
US-20100226917-A1 METHODS FOR THE TREATMENT OF HEMATOLOGIC MALIGNANCIES ASTRAZENECA AB (SE) 2010-09-09 US disclosed
US-20100056497-A1 AMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2010-03-04 US disclosed
EP-2119702-A1 AMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2009-11-18 EP disclosed
US-20090275570-A1 SUBSTITUTED HETEROCYCLES AND THEIR USE AS CHK1, PDK1 AND PAK INHIBITORS ASTRAZENECA AB (SE) 2009-11-05 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 (3 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-20090275570-A1 SUBSTITUTED HETEROCYCLES AND THEIR USE AS CHK1, PDK1 AND PAK INHIBITORS CHEK1, PDK1, CHEK2 PDE4B 1073/4885L3MBTL1 1826/4885KMT2A 1568/4885
US-20100226917-A1 METHODS FOR THE TREATMENT OF HEMATOLOGIC MALIGNANCIES CHEK1, CHEK2, MCL1 PDE4B 3034/4885L3MBTL1 388/4885KMT2A 74/4885
US-20100056497-A1 AMIDE DERIVATIVE REN, AGTR1, AGTR2 PDE4B 1175/4885L3MBTL1 3531/4885KMT2A 921/4885

“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.