SCHEMBL5318338

SCHEMBL5318338

O=P(O)(O)C(F)(F)c1ccc(Cn2c(-c3ccccc3)cc3ccccc32)cc1Br

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 10/20 0.48
PTPN2 P17706 3/20 0.48
PTPRC P08575 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 1/20 0.44
PTGS2 P35354 1/20 0.43
KMT2A Q03164 1/20 0.41
CCR2 P41597 1/20 0.40
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
PPARG P37231 2/20 0.39

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
SCHEMBL5320486 0.82 PTPN1 (0.36) PTPN1PTPN2PTPRCPTGS2PPARG
SCHEMBL5322648 0.81 PTPN1 (0.51) PTPN1PTPN2PTPRCALDH1A1KMT2A
SCHEMBL14090377 0.80 PTPN1 (0.46) PTPN1PTPN2PTPRC
SCHEMBL4897308 0.78 PTPN1 (0.45) PTPN1PTPN2PTPRCL3MBTL1
SCHEMBL5343124 0.76 PTPN1 (0.47) PTPN1PTPN2PTPRC
SCHEMBL5344606 0.75 HDAC1 (0.53) PTPN1PTPN2PTPRCALDH1A1PPARG
SCHEMBL4899977 0.75 PTPN1 (0.43) PTPN1PTPN2PTPRC
SCHEMBL4901303 0.75 PTPN1 (0.46) PTPN1PTPN2PTPRCL3MBTL1ALDH1A1
SCHEMBL4901508 0.75 PTPN1 (0.40) PTPN1PTPN2PTPRCL3MBTL1PTGS2
SCHEMBL4891791 0.74 PTPN1 (0.45) PTPN1PTPN2PTPRC

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
WO-2007081755-A2 INDOLE-BENZIMIDAZOLE AND INDAZOLE INHIBITORS OF TYROSINE PHOSPHATASES METABASIS THERAPEUTICS, INC. (US) 2007-07-19 WO disclosed
WO-2007081755-A2 INDOLE-BENZIMIDAZOLE AND INDAZOLE INHIBITORS OF TYROSINE PHOSPHATASES METABASIS THERAPEUTICS, INC. (US) 2007-07-19 WO disclosed