SCHEMBL9535978

SCHEMBL9535978

Nc1ccc(C(=O)NCc2ccccc2)cc1Sc1ccc(F)cc1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
TP53 P04637 3/20 0.49
LMNA P02545 2/20 0.49
PPARG P37231 2/20 0.49
ALDH1A1 P00352 3/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PLAU P00749 1/20 0.46
NAMPT P43490 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HDAC2 Q92769 6/20 0.45
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
NCOR2 Q9Y618 1/20 0.45
BLM P54132 1/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
CYP2D6 P10635 1/20 0.44
TSHR P16473 1/20 0.44
HPGD P15428 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
SCHEMBL9535539 0.84 MAPK14 (0.42) MAPTTP53ALDH1A1RXFP1HDAC2
SCHEMBL9534137 0.83 LMNA (0.50) MAPTTP53LMNAPPARGALDH1A1
SCHEMBL9536498 0.83 HDAC1 (0.49) HDAC2HDAC3HDAC1NCOR2HPGD
SCHEMBL9536630 0.81 MAPT (0.48) MAPTTP53LMNAPPARGALDH1A1
Diethylamine SCHEMBL9537391 0.81 MAPK14 (0.41) MAPTTP53ALDH1A1RXFP1HDAC2
SCHEMBL9537015 0.80 MAPK14 (0.48) MAPTALDH1A1PLAUHDAC2HDAC3
SCHEMBL9537385 0.78 L3MBTL1 (0.55) LMNAALDH1A1MAPK1SMN1; SMN2BLM
SCHEMBL9536752 0.77 ALDH1A1 (0.43) MAPTALDH1A1HDAC2HDAC3HDAC1
SCHEMBL14742975 0.77 PLAU (0.58) LMNAALDH1A1MAPK1PLAUHDAC2
SCHEMBL9534376 0.77 MAPK14 (0.46) MAPTALDH1A1HDAC1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0292979-B1 NEW ALKANESULFONANILIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-07-21 EP disclosed
US-5034417-A Antiinflammatory agents or analgesics FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-07-23 US disclosed
EP-0292979-A2 New alkanesulfonanilide derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-11-30 EP disclosed