SCHEMBL7700737

SCHEMBL7700737

O=c1[nH]ncc2nccn12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.39
PDE3A Q14432 2/20 0.39
ADORA3 P0DMS8 1/20 0.36
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
CCNE1 P24864 6/20 0.33
CDK2 P24941 6/20 0.33
PDE2A O00408 1/20 0.32
PDE6D O43924 1/20 0.32
PDE8A O60658 1/20 0.32
PDE5A O76074 1/20 0.32
PDE9A O76083 1/20 0.32
PDE8B O95263 1/20 0.32
PDE6A P16499 1/20 0.32
PDE6G P18545 1/20 0.32
PDE4A P27815 1/20 0.32
PDE6B P35913 1/20 0.32
PDE6C P51160 1/20 0.32
PDE1A P54750 1/20 0.32
PDE1B Q01064 1/20 0.32

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
SCHEMBL20848132 0.69 CHEK1 (0.33) ADORA3DRD1CHEK1MAP4K4CSF1R
SCHEMBL3521816 0.68 PDE3B (0.39) PDE3BPDE3APRMT5WDR77PDE2A
SCHEMBL557383 0.68 MAP2K1 (0.44) PDE3BPDE3AADORA3CCNE1CDK2
SCHEMBL557300 0.67 GRIN2D (0.41) PDE3BPDE3AADORA3CCNE1CDK2
SCHEMBL7701729 0.64 LTK (0.41) PDE3BPDE3ACDK2PDE5APDE4B
SCHEMBL3527613 0.62 PDE3B (0.48) PDE3BPDE3ACCNE1CDK2CCNE2
SCHEMBL17796160 0.62 PDE3B (0.51) PDE3BPDE3ACCNE1CDK2CCNE2
SCHEMBL7704795 0.62 ALDH1A1 (0.32) XDH
SCHEMBL16447534 0.62 PDE3B (0.51) PDE3BPDE3ACCNE1CDK2CCNE2
SCHEMBL15174581 0.61 ADORA3 (0.60) ADORA3PRMT5WDR77PDE2ACDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0185346-A2 Imidazo derivatives, their preparation and medicaments containing these compounds Dr. Karl Thomae GmbH (DE) 1986-06-25 EP claimed
US-8575114-B2 SGLT-2 inhibitors, methods of making them, and uses thereof ALBANY MOLECULAR RESEARCH, INC. (US) 2013-11-05 US disclosed
US-8575114-B2 SGLT-2 inhibitors, methods of making them, and uses thereof ALBANY MOLECULAR RESEARCH, INC. (US) 2013-11-05 US disclosed
US-20110237527-A1 SGLT-2 INHIBITORS, METHODS OF MAKING THEM, AND USES THEREOF ALBANY MOLECULAR RESEARCH, INC. (US) 2011-09-29 US disclosed
US-20110237527-A1 SGLT-2 INHIBITORS, METHODS OF MAKING THEM, AND USES THEREOF ALBANY MOLECULAR RESEARCH, INC. (US) 2011-09-29 US disclosed
WO-2002081473-A1 SUBSTITUTED AZOLOAZIN(THI)ONES BAYER CROPSCIENCE AG (DE) 2002-10-17 WO disclosed
EP-0185346-A2 Imidazo derivatives, their preparation and medicaments containing these compounds Dr. Karl Thomae GmbH (DE) 1986-06-25 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-20110237527-A1 SGLT-2 INHIBITORS, METHODS OF MAKING THEM, AND USES THEREOF SLC5A2, SLC5A1, SLC10A1 PDE3B 1628/4885PDE3A 1424/4885ADORA3 3769/4885

“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.