SCHEMBL6948898

SCHEMBL6948898

O=C(O)c1coc2c1C(=O)CC2

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.36
LDHA P00338 1/20 0.34
NAMPT P43490 1/20 0.34
NTRK3 Q16288 1/20 0.33
NTRK2 Q16620 1/20 0.33
IDO1 P14902 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
SCHEMBL760652 0.89 NAMPT (0.42) MAOBLDHANAMPTNTRK3NTRK2
SCHEMBL6762871 0.89 NAMPT (0.40) MAOBLDHANAMPTNTRK3NTRK2
SCHEMBL16943023 0.77 LDHA (0.35) MAOBLDHANTRK3NTRK2
SCHEMBL16931210 0.75 CHEK1 (0.37) MAOBLDHANTRK3
SCHEMBL2318795 0.74 NTRK3 (0.59) NTRK3NTRK2IDO1
SCHEMBL6947652 0.74 HTR2A (0.34) MAOBLDHANTRK3NTRK2IDO1
SCHEMBL16931466 0.74 NTRK3 (0.40) MAOBLDHANTRK3NTRK2IDO1
SCHEMBL5444456 0.73 NAMPT (0.41) NAMPTNTRK3NTRK2
SCHEMBL5189062 0.73 NAMPT (0.41) NAMPTNTRK3NTRK2
SCHEMBL16931551 0.73 CDK5 (0.36) MAOBLDHANAMPTNTRK3

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 8 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 claimed
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 claimed
EP-1030838-A1 METHOD OF SYNTHESIS OF PYRROLE AMIDES Pfizer Products Inc. (US) 2000-08-30 EP claimed
WO-1999025684-A1 METHOD OF SYNTHESIS OF PYRROLE AMIDES PFIZER PRODUCTS INC. (US) 1999-05-27 WO claimed
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