SCHEMBL7573697

SCHEMBL7573697

O=C(O)C(Nc1c(Cl)cc(O)cc1Cl)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CAMK2A Q9UQM7 1/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
FTO Q9C0B1 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MCL1 Q07820 2/20 0.37
CYP2D6 P10635 1/20 0.37
SRC P12931 1/20 0.37
ACLY P53396 1/20 0.37
FPR2 P25090 1/20 0.37
NAALAD2 Q9Y3Q0 1/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL7161999 0.91 KYNU (0.42) CAMK2ACA1CA2FTOMEN1
SCHEMBL7574221 0.89 ALDH1A1 (0.44) CA1CA2MEN1KMT2AALDH1A1
SCHEMBL360635 0.85 CXCL8 (0.45) CA1CA2MEN1KMT2ACYP3A4
SCHEMBL6809250 0.83 CXCL8 (0.44) CA1CA2MEN1KMT2ACYP3A4
SCHEMBL11271011 0.83 CXCL8 (0.44) CA1CA2MEN1KMT2ACYP3A4
SCHEMBL7165977 0.83 OPRK1 (0.44) CAMK2ACA1CA2MEN1KMT2A
SCHEMBL7573910 0.82 ATM (0.46) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL7582482 0.81 CA1 (0.46) CAMK2ACA1CA2MEN1KMT2A
SCHEMBL7576888 0.78 CLCN2 (0.50) CA1CA2MEN1KMT2ACYP3A4
SCHEMBL7584713 0.77 CA1 (0.44) CA1CA2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958978-A ADMINISTERING 2-(2,6-DICHLORO-4-HYDROXYANILINO)PHENYLACETIC ACID KABUSHIKI KAISHA YAKULT HONSHA (JP) 1999-09-28 US claimed
EP-1242069-A2 ALBUMIN-BINDING COMPOUNDS THAT PREVENT NONENZYMATIC GLYCATION AND THAT MAY BE USED FOR TREATMENT OF GLYCATION-RELATED PATHOLOGIES EXOCELL, INC. (US) 2002-09-25 EP disclosed
WO-2001003684-A2 ALBUMIN-BINDING COMPOUNDS THAT PREVENT NONENZYMATIC GLYCATION AND THAT MAY BE USED FOR TREATMENT OF GLYCATION-RELATED PATHOLOGIES EXOCELL, INC. (US) 2001-01-18 WO disclosed
EP-0865788-A4 SPECIFIC CYCLOOXYGENASE 2 INHIBITOR AND ANTI-INFLAMMATORY AGENT YAKULT HONSHA KK (JP) 2000-04-26 EP disclosed
US-5958978-A ADMINISTERING 2-(2,6-DICHLORO-4-HYDROXYANILINO)PHENYLACETIC ACID KABUSHIKI KAISHA YAKULT HONSHA (JP) 1999-09-28 US disclosed
WO-1997009977-A1 SPECIFIC CYCLOOXYGENASE 2 INHIBITOR AND ANTI-INFLAMMATORY AGENT KABUSHIKI KAISHA YAKULT HONSHA (JP) 1997-03-20 WO disclosed