SCHEMBL7827337

SCHEMBL7827337

NC(=O)c1ccccc1NC(=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.55
CD274 Q9NZQ7 1/20 0.55
KDM4E B2RXH2 7/20 0.54
ALDH1A1 P00352 5/20 0.54
LMNA P02545 1/20 0.54
HPGD P15428 3/20 0.49
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
MAPK14 Q16539 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
CASP3 P42574 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SIRT2 Q8IXJ6 2/20 0.46
GLA P06280 1/20 0.45
POLB P06746 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL7820722 0.81 CYP1A2 (0.57) KDM4EALDH1A1LMNAHPGDMEN1
SCHEMBL7821493 0.79 HPGD (0.58) KDM4EALDH1A1LMNAHPGDMEN1
SCHEMBL7823201 0.79 TAS1R3 (0.55) ALDH1A1LMNAMEN1KMT2ANPC1
SCHEMBL11284668 0.78 PDCD1 (0.64) PDCD1CD274KDM4EALDH1A1HPGD
SCHEMBL29360280 0.77 MEN1 (0.57) KDM4EALDH1A1LMNAHPGDMEN1
SCHEMBL42567 0.77 MEN1 (0.57) KDM4EALDH1A1LMNAHPGDMEN1
SCHEMBL786246 0.76 PDCD1 (0.81) PDCD1CD274KDM4EALDH1A1HPGD
SCHEMBL2761484 0.76 GAA (0.55) KDM4EALDH1A1LMNAHPGDMEN1
SCHEMBL11248349 0.75 SMN1; SMN2 (0.52) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL10481401 0.74 KMT2A (0.60) PDCD1CD274KDM4EALDH1A1HPGD

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-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed