SCHEMBL5757053

SCHEMBL5757053

Cc1cc2c(cc1O)NC(=O)C2(C)C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.46
PDK2 Q15119 1/20 0.44
PDK4 Q16654 1/20 0.44
KMT2A Q03164 2/20 0.43
MAPK14 Q16539 3/20 0.43
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
XBP1 P17861 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PDE3B Q13370 3/20 0.42
PDE3A Q14432 3/20 0.42
PDE4A P27815 2/20 0.42
PDE4B Q07343 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
PGR P06401 6/20 0.41
AURKA O14965 3/20 0.40
AURKB Q96GD4 3/20 0.40

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
SCHEMBL10517587 0.80 ATAD2 (0.45) ATAD2PDK2PDK4MAPK14PDE3B
Hydrochloric Acid SCHEMBL9559266 0.79 ATAD2 (0.44) ATAD2PDK2PDK4MAPK14PDE3B
SCHEMBL31219578 0.78 BCHE (0.47) ATAD2PDK2PDK4MAPK14PDE3B
SCHEMBL31335589 0.77 ATAD2 (0.42) ATAD2PDK2PDK4MAPK14PDE3B
SCHEMBL31335591 0.77 ATAD2 (0.42) ATAD2PDK2PDK4MAPK14PDE3B
SCHEMBL25156363 0.77 MAPK14 (0.46) ATAD2PDK2PDK4KMT2AMAPK14
SCHEMBL9559318 0.75 PGR (0.48) ATAD2PDK2PDK4KMT2AMEN1
SCHEMBL24690662 0.74 AKR1B1 (0.50) ATAD2PDK2PDK4MAPK14PDE3B
SCHEMBL25156270 0.74 MAPK14 (0.43) ATAD2PDK2PDK4MAPK14LMNA
SCHEMBL10507860 0.73 AURKA (0.45) ATAD2PDK2PDK4MAPK14PDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060241138-A1 Heterocyclic amide derivatives for the treatment of diabetes and other diseases PFAHL MAGNUS 2006-10-26 US disclosed
US-7102000-B2 Heterocyclic amide derivatives for the treatment of diabetes and other diseases INCYTE SAN DIEGO INC. (US) 2006-09-05 US disclosed
EP-1487443-A4 HETEROCYCLIC AMIDE DERIVATIVES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES INCYTE SAN DIEGO INC (US) 2006-04-12 EP disclosed
CN-1649586-A Heterocyclic amide derivatives for the treatment of diabetes and other diseases INCYTE SAN DIEGO INC (US) 2005-08-03 CN disclosed
EP-1487443-A1 HETEROCYCLIC AMIDE DERIVATIVES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES Incyte San Diego Incorporated (US) 2004-12-22 EP disclosed
US-20030216432-A1 Heterocyclic amide derivatives for the treatment of diabetes and other diseases ORTHO MCNEIL PHARMACEUTICAL INC. 2003-11-20 US disclosed
WO-2003075924-A1 HETEROCYCLIC AMIDE DERIVATIVES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES INCYTE SAN DIEGO INCORPORATED (US) 2003-09-18 WO disclosed
US-4622336-A ANALGESICS SANDOZ LTD. (CH) 1986-11-11 US disclosed
WO-1983002610-A1 DERIVATIVES OF 3,3-DIALKYL-INDOLIN AND OF 3,3-ALKYLENE-INDOLIN, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM SANDOZ AG (CH) 1983-08-04 WO 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 (2 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-20060241138-A1 Heterocyclic amide derivatives for the treatment of diabetes and other diseases HDAC5, KAT5, IGFBP5 ATAD2 592/4885PDK2 246/4885PDK4 166/4885
US-20030216432-A1 Heterocyclic amide derivatives for the treatment of diabetes and other diseases GCKR, HDAC5, GPR119 ATAD2 285/4885PDK2 133/4885PDK4 134/4885

“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.