SCHEMBL7800637

SCHEMBL7800637

O=C(COc1ccc(F)cc1)OC(=O)Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.56
MAPK1 P28482 1/20 0.56
CASP3 P42574 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
THRB P10828 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GPR34 Q9UPC5 1/20 0.46
PAM P19021 1/20 0.46
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
CNR2 P34972 1/20 0.46
USP2 O75604 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL27568652 0.83 LMNA (0.60) LMNAMAPK1CASP3SENP7SENP6
Phenylacetic Acid SCHEMBL7800635 0.81 ALOX15 (0.59) LMNAMAPK1CASP3SENP7SENP6
SCHEMBL264346 0.78 ALOX15 (0.68) L3MBTL1KMT2AMEN1ALDH1A1GAA
SCHEMBL248113 0.78 ALDH1A1 (0.65) MAPK1L3MBTL1KMT2AMEN1ALDH1A1
Phenylacetic Acid SCHEMBL29250510 0.78 LMNA (0.55) LMNAMAPK1CASP3SENP7SENP6
SCHEMBL4645871 0.78 MAPT (0.47) LMNAMAPK1CASP3SENP7SENP6
SCHEMBL27900792 0.76 ALDH1A1 (0.51) LMNAMAPK1CASP3SENP7SENP6
SCHEMBL4646403 0.76 MAPT (0.48) LMNAMAPK1CASP3SENP7SENP6
SCHEMBL4646407 0.76 MAPT (0.51) LMNAMAPK1CASP3SENP7SENP6
SCHEMBL4642326 0.75 MAPT (0.45) LMNAMAPK1CASP3SENP7SENP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1161421-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE Pharmacia & Upjohn Aktiebolag (SE) 2001-12-12 EP disclosed
WO-2000053583-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE BIOVITRUM AB (SE) 2000-09-14 WO disclosed