SCHEMBL6948324

SCHEMBL6948324

O=C(O)c1c[nH]c2c1C(=O)CC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
KDM3B Q7LBC6 1/20 0.39
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
DYRK1A Q13627 1/20 0.35
PTK2 Q05397 1/20 0.34
CSNK2A1 P68400 5/20 0.33
CSNK2A2 P19784 4/20 0.33
CSNK2B P67870 4/20 0.33
KMT2A Q03164 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
CYP1A2 P05177 1/20 0.33
F7 P08709 1/20 0.33
F3 P13726 1/20 0.33
NOTUM Q6P988 1/20 0.32
PIM3 Q86V86 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
GFER P55789 1/20 0.32
LDHA P00338 1/20 0.31

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
SCHEMBL6952749 0.89 KDM4E (0.45) KDM4EKDM3BALDH1A1HSD17B10HPGD
SCHEMBL1663484 0.89 PTK2 (0.46) KDM4EKDM3BALDH1A1HSD17B10HPGD
SCHEMBL3429404 0.79 PTK2 (0.44) KDM4EKDM3BALDH1A1HSD17B10HPGD
SCHEMBL6778119 0.75 KDM4E (0.35) KDM4EKDM3BALDH1A1HSD17B10HPGD
SCHEMBL6767802 0.74 ALPL (0.39) KDM4EALDH1A1HSD17B10HPGDKMT2A
SCHEMBL7394232 0.73 ALDH1A1 (0.39) KDM4EALDH1A1HSD17B10HPGDDYRK1A
SCHEMBL7385629 0.73 ROCK2 (0.47) KDM4EKDM3BALDH1A1HSD17B10HPGD
SCHEMBL7381669 0.70 HTT (0.34) KDM4EKDM3BHSD17B10HPGDKMT2A
SCHEMBL6304807 0.69 TSHR (0.52) ALDH1A1PTK2
SCHEMBL28986056 0.69 KDM4E (0.39) KDM4EKDM3BALDH1A1HSD17B10HPGD

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
EP-1030838-B1 METHOD OF SYNTHESIS OF PYRROLE AMIDES PFIZER PROD INC (US) 2003-01-22 EP disclosed
US-6262272-B1 REACTING FURAN CARBOXYLIC ACID DERIVATIVE WITH ACID CHLORIDE OR ACID ANHYDRIDE IN INERT SOLVENT CONTAINING ACID RECEPTOR; ADDING AROMATIC AMINE COMPOUND TO FORM PYRROLE CARBOXAMIDE COMPOUND PFIZER INC 2001-07-17 US disclosed
EP-1030838-A1 METHOD OF SYNTHESIS OF PYRROLE AMIDES Pfizer Products Inc. (US) 2000-08-30 EP disclosed
WO-1999025684-A1 METHOD OF SYNTHESIS OF PYRROLE AMIDES PFIZER PRODUCTS INC. (US) 1999-05-27 WO disclosed