SCHEMBL9537379

SCHEMBL9537379

CCN(CC)C(C)NC(=O)c1ccc(N)c(Sc2ccc(F)cc2F)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
HDAC1 Q13547 3/20 0.35
TP53 P04637 1/20 0.35
MAPK14 Q16539 7/20 0.35
HDAC6 Q9UBN7 1/20 0.34
LMNA P02545 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PPARG P37231 1/20 0.34
NAMPT P43490 2/20 0.34
KCNQ3 O43525 1/20 0.34
KCNQ2 O43526 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC2 Q92769 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL9536752 0.86 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL9535494 0.84 USP7 (0.43) ALDH1A1HPGDKDM4EMAPTPPARG
Hydrochloric Acid SCHEMBL9539504 0.82 PTGS2 (0.44) ALDH1A1KDM4ETP53MAPK14LMNA
SCHEMBL9535539 0.81 MAPK14 (0.42) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL9537015 0.80 MAPK14 (0.48) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL9537385 0.79 L3MBTL1 (0.55) ALDH1A1HPGDKDM4EMAPK14LMNA
Diethylamine SCHEMBL9537391 0.78 MAPK14 (0.41) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL9538792 0.77 MAPT (0.40) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL9535502 0.76 MAPT (0.46) ALDH1A1HPGDKDM4EMAPTHDAC1
SCHEMBL9535727 0.75 ALDH1A1 (0.40) ALDH1A1HPGDKDM4EMAPTHDAC1

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