SCHEMBL4226499

SCHEMBL4226499

O=C(NS(=O)(=O)Nc1cc(F)ccc1Oc1ccc(F)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
BCL2L1 Q07817 2/20 0.51
MCL1 Q07820 2/20 0.51
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
CCR2 P41597 1/20 0.46
F10 P00742 1/20 0.46
PTGER4 P35408 1/20 0.43
PTGER2 P43116 1/20 0.43
PYGL P06737 1/20 0.43
CACNA1H O95180 2/20 0.43
KMT2A Q03164 2/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PNLIP P16233 1/20 0.41

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
SCHEMBL4226495 0.81 LMNA (0.46) LMNAL3MBTL1SMN1; SMN2BCL2L1MCL1
SCHEMBL28842084 0.78 HDAC1 (0.49) LMNASMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL4081368 0.76 CCR2 (0.60) CCR2KMT2AMEN1
SCHEMBL3049477 0.76 CCR2 (0.62) LMNAKDM4EALDH1A1CCR2PTGER4
SCHEMBL31090892 0.75 PTGS1 (0.55) LMNAL3MBTL1SMN1; SMN2KDM4EALDH1A1
SCHEMBL3050565 0.75 CCR2 (0.64) LMNAKDM4EALDH1A1CCR2KMT2A
SCHEMBL3274441 0.74 CCR2 (0.50) LMNABCL2L1MCL1KDM4EALDH1A1
SCHEMBL27716682 0.70 L3MBTL1 (0.65) LMNAL3MBTL1SMN1; SMN2ALDH1A1CACNA1H
SCHEMBL11165536 0.70 EPHX1 (0.60) LMNAL3MBTL1SMN1; SMN2KDM4EALDH1A1
SCHEMBL680346 0.70 SCN9A (0.57) BCL2L1MCL1

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-2076491-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS Richter Gedeon NYRT (HU) 2009-07-08 EP disclosed
WO-2008068540-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2008-06-12 WO disclosed