SCHEMBL9658331

SCHEMBL9658331

CCOC(=O)C(C(=O)OCC)C(=O)c1cc(Oc2ccc(F)cc2F)c([N+](=O)[O-])cc1C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 5/20 0.49
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
FBP1 P09467 1/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL9655283 0.82 HSPB1 (0.57) HSPB1L3MBTL1SMN1; SMN2LMNAPOLB
SCHEMBL9658316 0.82 HSPB1 (0.57) HSPB1L3MBTL1MAPTALDH1A1KMT2A
SCHEMBL9657033 0.82 HSPB1 (0.56) HSPB1L3MBTL1MAPTALDH1A1KMT2A
SCHEMBL10960022 0.78 HSPB1 (0.68) HSPB1L3MBTL1MAPTKMT2AMEN1
SCHEMBL9655263 0.78 HSPB1 (0.51) HSPB1MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL10956911 0.75 HSPB1 (0.63) HSPB1L3MBTL1MAPTKMT2ALMNA
SCHEMBL9658338 0.75 HSPB1 (0.46) HSPB1L3MBTL1MAPTALDH1A1FBP1
SCHEMBL8136193 0.73 RECQL (0.44) L3MBTL1MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL9416413 0.73 CES2 (0.50) L3MBTL1MAPTALDH1A1KMT2ALMNA
SCHEMBL9655201 0.73 HSPB1 (0.53) HSPB1L3MBTL1MAPTALDH1A1KMT2A

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-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
EP-0273369-A2 New alkanesulfonanilide derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-07-06 EP disclosed