SCHEMBL6983341

SCHEMBL6983341

Cc1cc(CO)ccc1NS(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 4/20 0.56
FFAR4 Q5NUL3 1/20 0.56
TP53 P04637 2/20 0.53
POLB P06746 1/20 0.53
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
TSHR P16473 1/20 0.50
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
BRD4 O60885 1/20 0.49
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL6983562 0.86 FFAR4 (0.56) METAP2FFAR4TP53POLBKEAP1
SCHEMBL6976064 0.83 ALDH1A1 (0.60) METAP2KMT2AMEN1LMNAMAPT
SCHEMBL15830106 0.78 KEAP1 (0.54) METAP2FFAR4POLBKEAP1NFE2L2
SCHEMBL18088741 0.77 ADRA2A (0.45) KEAP1NFE2L2LMNAMAPTHTT
SCHEMBL7589428 0.77 FFAR4 (0.67) METAP2FFAR4TP53POLBKEAP1
SCHEMBL6980613 0.76 FFAR1 (0.64) FFAR4POLBKMT2AMEN1LMNA
SCHEMBL6978287 0.76 CYP2C9 (0.64) METAP2FFAR4TP53POLBTSHR
SCHEMBL13852947 0.75 NPC1 (0.58) METAP2FFAR4POLBKEAP1NFE2L2
SCHEMBL6971665 0.75 HTT (0.54) FFAR4KMT2AMEN1BRD4LMNA
SCHEMBL6973491 0.74 IKBKB (0.69) KMT2AMEN1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1109560-B1 COMPOUNDS USEFUL AS AICARFT INHIBITORS AGOURON PHARMA (US) 2003-08-27 EP disclosed
US-6525050-B1 Inhibit the enzyme aminoimidazole carboxamide ribonucleotide formyl transferase; antiproliferative agents; antitumor, antiinflammatory, antipsoriatic, and/or immunosuppressive AGOURON PHARMACEUTICALS, INC. 2003-02-25 US disclosed
EP-1109560-A4 COMPOUNDS USEFUL AS AICARFT INHIBITORS AGOURON PHARMA (US) 2002-04-17 EP disclosed
EP-1109560-A1 COMPOUNDS USEFUL AS AICARFT INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 2001-06-27 EP disclosed
WO-2000013688-A1 COMPOUNDS USEFUL AS AICARFT INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 2000-03-16 WO disclosed