SCHEMBL5167932

SCHEMBL5167932

CCOP(=O)(OCC)C(F)(F)c1ccc(CC(NC(=O)NCc2ccccc2)c2ccc(C(F)(F)P(=O)(OCC)OCC)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.45
CCR3 P51677 1/20 0.44
UTS2R Q9UKP6 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 2/20 0.43
PPARG P37231 4/20 0.43
EPHX2 P34913 3/20 0.43
MAPT P10636 2/20 0.41
KLKB1 P03952 1/20 0.41
PPID Q08752 1/20 0.41
ANPEP P15144 1/20 0.41
PPARA Q07869 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL5178818 0.91 PPARG (0.38) ATMCCR3UTS2RL3MBTL1ALDH1A1
SCHEMBL5189648 0.80 PTPN1 (0.44) ATMCCR3UTS2RL3MBTL1ALDH1A1
SCHEMBL5178812 0.76 PTGDR2 (0.45) PPIDLMNA
SCHEMBL14450445 0.73 PTPN1 (0.48) PPARGEPHX2PPARA
SCHEMBL7244978 0.73 PTPN1 (0.46) ALDH1A1PPARGLMNA
SCHEMBL7244973 0.73 PTPN1 (0.46) ALDH1A1PPARGLMNA
SCHEMBL3745964 0.73 ITGB3 (0.53) ALDH1A1
SCHEMBL3745962 0.73 ITGB3 (0.53) ALDH1A1
SCHEMBL2423462 0.72 PTPN1 (0.67) ALDH1A1MAPTLMNA
SCHEMBL7876107 0.72 PTPN1 (0.67) ALDH1A1MAPTLMNA

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-1765332-A2 TRISUBSTITUTED NITROGEN MODULATORS OF TYROSINE PHOSPHATASES Cengent Therapeutics, Inc. (US) 2007-03-28 EP disclosed
WO-2006009876-A2 TRISUBSTITUTED NITROGEN MODULATORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-01-26 WO disclosed