SCHEMBL7114649

SCHEMBL7114649

NC(=O)c1ccccc1OCCCO

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.69
KMT2A Q03164 3/20 0.69
MEN1 O00255 2/20 0.69
MAPT P10636 2/20 0.69
NR1I2 O75469 1/20 0.69
CHRM2 P08172 1/20 0.69
CYP3A4 P08684 1/20 0.69
ADRA2A P08913 1/20 0.69
OPRK1 P41145 1/20 0.69
HTR2B P41595 1/20 0.69
SLC6A3 Q01959 1/20 0.69
HDAC6 Q9UBN7 1/20 0.69
KDM4E B2RXH2 3/20 0.64
HTT P42858 2/20 0.64
PARP1 P09874 2/20 0.55
HTR1A P08908 1/20 0.55
TBXAS1 P24557 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
CTNNB1 P35222 1/20 0.51
ALDH1A1 P00352 3/20 0.50

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
SCHEMBL1894429 0.91 KMT2A (0.66) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL1892934 0.86 KMT2A (0.64) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL14157583 0.86 KMT2A (0.69) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL14359359 0.84 LMNA (0.71) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL6835723 0.84 LMNA (0.88) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL11552814 0.84 KMT2A (0.67) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL122684 0.84 ALDH1A1 (0.71) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL29550999 0.84 ALDH1A1 (0.71) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL11547493 0.84 KDM4E (0.66) LMNAKMT2AMEN1MAPTNR1I2
SCHEMBL7325672 0.83 PARP1 (0.60) LMNAKMT2AMEN1MAPTNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1301472-A2 OXYGENATED ESTERS OF 4-IODO PHENYLAMINO BENZHYDROXAMIC ACIDS WARNER-LAMBERT COMPANY (US) 2003-04-16 EP disclosed
WO-2002006213-A2 OXYGENATED ESTERS OF 4-IODO PHENYLAMINO BENZHYDROXAMIC ACIDS WARNER-LAMBERT COMPANY (US) 2002-01-24 WO disclosed
US-4742083-A Method of relieving pain and inflammatory conditions employing substituted salicylamides LEVER BROTHERS COMPANY (US) 1988-05-03 US disclosed
US-4725590-A SKIN DISORDERS; ANTIACNE SHAMPOO AND SOAP LEVER BROTHERS COMPANY (US) 1988-02-16 US disclosed
US-4560549-A TOPICAL AND SYSTEMICAL; HUMANS ANIMALS; MICROBIOCIDES LEVER BROTHERS COMPANY (US) 1985-12-24 US disclosed