SCHEMBL9538256

SCHEMBL9538256

CC(=O)c1ccc(N)c(Nc2ccc(F)cc2F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 5/20 0.49
PRKCI P41743 1/20 0.49
HDAC3 O15379 1/20 0.48
HDAC2 Q92769 1/20 0.48
NCOR2 Q9Y618 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.45
MAPT P10636 4/20 0.45
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
ALOX12 P18054 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 4/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
HTT P42858 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL9535897 0.87 HDAC1 (0.50) HDAC1HDAC3HDAC2NCOR2SMN1; SMN2
SCHEMBL9535652 0.80 PTGS2 (0.54) SMN1; SMN2MAPTMEN1ALDH1A1POLB
SCHEMBL9539498 0.79 AKR1C3 (0.53) SMN1; SMN2MAPTMEN1ALDH1A1POLB
SCHEMBL9538281 0.77 CA1 (0.44) SMN1; SMN2MAPTMEN1ALDH1A1POLB
SCHEMBL9536549 0.74 PRKCI (0.49) HDAC1PRKCIHDAC2SMN1; SMN2MAPT
SCHEMBL15638643 0.74 ALDH1A1 (0.47) HDAC1SMN1; SMN2MAPTALDH1A1ALOX12
SCHEMBL121984 0.74 PRKCI (0.59) HDAC1PRKCIHDAC3HDAC2NCOR2
SCHEMBL27111060 0.73 PRKCI (0.73) HDAC1PRKCIHDAC3HDAC2MAPT
SCHEMBL17676671 0.73 PRKCI (0.58) HDAC1PRKCIHDAC3HDAC2MAPT
SCHEMBL11542046 0.73 MAOB (0.48) HDAC1PRKCIHDAC3HDAC2NCOR2

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