SCHEMBL7487663

SCHEMBL7487663

O=C(O)/C=C/c1ccc(F)cc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 2/20 0.52
NFE2L2 Q16236 2/20 0.52
USP2 O75604 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
NPSR1 Q6W5P4 1/20 0.48
CCR2 P41597 1/20 0.46
IKBKB O14920 1/20 0.46
SLC40A1 Q9NP59 1/20 0.45
METAP2 P50579 2/20 0.44
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
MPI P34949 1/20 0.43
KMT2A Q03164 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43

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
SCHEMBL7487670 1.00 KEAP1 (0.52) KEAP1NFE2L2USP2TDP1NPSR1
SCHEMBL7488003 0.91 KEAP1 (0.53) KEAP1NFE2L2USP2TDP1NPSR1
SCHEMBL7488011 0.91 KEAP1 (0.53) KEAP1NFE2L2USP2TDP1NPSR1
SCHEMBL7482719 0.89 KDM4E (0.50) KEAP1NFE2L2USP2TDP1NPSR1
SCHEMBL7482712 0.89 KDM4E (0.50) KEAP1NFE2L2USP2TDP1NPSR1
SCHEMBL6172083 0.84 ERBB2 (0.57) KEAP1NFE2L2CCR2LMNAMAPT
SCHEMBL6172085 0.84 ERBB2 (0.57) KEAP1NFE2L2CCR2LMNAMAPT
SCHEMBL7493057 0.84 METAP2 (0.58) KEAP1NFE2L2NPSR1METAP2ALDH1A1
SCHEMBL7493052 0.84 METAP2 (0.58) KEAP1NFE2L2NPSR1METAP2ALDH1A1
SCHEMBL7482984 0.84 MEN1 (0.52) KEAP1NFE2L2USP2CCR2MEN1

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-1065206-B1 Tetrazolylalkyl indole compounds as anti-inflammatory and analgesic agents PFIZER (US) 2002-10-09 EP disclosed
EP-1065206-A1 Tetrazolylalkyl indole compounds as anti-inflammatory and analgesic agents PFIZER INC. (US) 2001-01-03 EP disclosed