SCHEMBL9657442

SCHEMBL9657442

CC(=O)c1ccc(N)c(Oc2ccc(F)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 2/20 0.49
HPGD P15428 1/20 0.49
RAB9A P51151 1/20 0.49
MAOB P27338 4/20 0.47
BRAF P15056 1/20 0.46
HDAC1 Q13547 1/20 0.46
PARP10 Q53GL7 1/20 0.44
CREBBP Q92793 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
BACE1 P56817 1/20 0.42
IKBKB O14920 1/20 0.41
PRKCI P41743 1/20 0.41
ICAM1 P05362 1/20 0.40
SELE P16581 1/20 0.40
RELA Q04206 2/20 0.40
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL9657030 0.85 MAPT (0.49) ALDH1A1MAPTHPGDRAB9AMAOB
SCHEMBL9655279 0.84 TTR (0.53) ALDH1A1GAAMAPTHPGDRAB9A
SCHEMBL9658204 0.82 CREBBP (0.46) ALDH1A1GAAMAPTMAOBHDAC1
SCHEMBL3366867 0.81 ALDH1A1 (0.55) ALDH1A1GAAMAPTHPGDRAB9A
SCHEMBL9657506 0.81 PARP10 (0.50) ALDH1A1GAAMAPTHPGDMAOB
SCHEMBL9656925 0.80 CREBBP (0.43) ALDH1A1GAAHPGDCREBBP
SCHEMBL3138940 0.78 HPGD (0.79) ALDH1A1GAAMAPTHPGDRAB9A
SCHEMBL9658219 0.77 HSPB1 (0.53) ALDH1A1GAAMAPTHPGDRAB9A
SCHEMBL21186228 0.77 NR4A1 (0.50) ALDH1A1GAAMAPTHPGDBRAF
SCHEMBL9657052 0.76 SMN1; SMN2 (0.50) ALDH1A1RAB9ACREBBPSMN1; SMN2LMNA

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-0273369-B1 NEW ALKANESULFONANILIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-03-04 EP disclosed
US-4866091-A ANTINFLAMMATORY AGENTS, ANALGESICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-09-12 US disclosed