SCHEMBL7848417

SCHEMBL7848417

O=C(O)C(=O)Nc1cc(F)ccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.56
PTPN2 P17706 4/20 0.51
PTPRB P23467 3/20 0.51
PTPN6 P29350 3/20 0.51
PTPRC P08575 2/20 0.51
PTPRE P23469 2/20 0.51
PTPRA P18433 1/20 0.51
GRIK1 P39086 4/20 0.51
CLCN2 P51788 1/20 0.47
KEAP1 Q14145 1/20 0.46
NPC1 O15118 1/20 0.44
GPR35 Q9HC97 3/20 0.43
KCNK2 O95069 1/20 0.43

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
SCHEMBL7836703 0.86 PTPN1 (0.65) PTPN1PTPN2PTPRBPTPN6PTPRC
SCHEMBL7144739 0.82 KDM4E (0.51) GRIK1CLCN2KEAP1NPC1KCNK2
SCHEMBL7848210 0.80 GPR35 (0.58) PTPN1PTPN2PTPRBPTPN6PTPRC
SCHEMBL9744446 0.79 GRIK1 (0.49) GRIK1CLCN2KEAP1NPC1
SCHEMBL9743950 0.79 GRIK1 (0.56) GRIK1CLCN2KEAP1NPC1KCNK2
SCHEMBL7847232 0.79 ACLY (0.59) PTPN1PTPN2PTPRBPTPN6PTPRC
SCHEMBL7846225 0.79 GRIK1 (0.64) PTPN1GRIK1
SCHEMBL9743979 0.78 MAPT (0.58) GRIK1NPC1
SCHEMBL13885544 0.78 ALDH1A1 (0.51) GRIK1CLCN2KEAP1
SCHEMBL12798622 0.78 GRIK1 (0.51) GRIK1CLCN2KEAP1NPC1

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-1062199-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2000-12-27 EP claimed
WO-1999046236-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 1999-09-16 WO claimed
US-6225329-B1 USEFUL IN THE TREATMENT OF TYPE I DIABETES, TYPE II DIABETES, IMPAIRED GLUCOSE TOLERANCE, INSULIN AUTOIMMUNITY DISEASES WITH DYSFUNCTIONS OF THE COAGULATION SYSTEM, ALLERGIC DISEASES NOVO NORDISK A/S (DK) 2001-05-01 US disclosed
EP-1080068-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES Novo Nordisk A/S (DK) 2001-03-07 EP disclosed
EP-1062199-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 2000-12-27 EP disclosed
WO-1999046237-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES NOVO NORDISK A/S (DK) 1999-09-16 WO disclosed
WO-1999046236-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPASES) NOVO NORDISK A/S (DK) 1999-09-16 WO disclosed