Ibuproxam

Ibuproxam

SCHEMBL8722617

CC(C)Cc1ccc([C@H](C)C(=O)NO)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 1.00
PDE4A P27815 1/20 1.00
CXCR1 P25024 5/20 0.69
CXCR2 P25025 5/20 0.69
PTGS1 P23219 3/20 0.66
PTGS2 P35354 3/20 0.66
LMNA P02545 2/20 0.66
CYP2C9 P11712 2/20 0.66
AKR1C3 P42330 2/20 0.66
ALOX5 P09917 2/20 0.66
ALB P02768 1/20 0.66
ESR1 P03372 1/20 0.66
RARB P10826 1/20 0.66
ADRB3 P13945 1/20 0.66
NFKB1 P19838 1/20 0.66
HTR2A P28223 1/20 0.66
NR1I3 Q14994 1/20 0.66
SLC22A6 Q4U2R8 1/20 0.66
CXCL8 P10145 1/20 0.66
TSHR P16473 1/20 0.66

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
Ibuproxam SCHEMBL24896 1.00 CHRM1 (1.00) CHRM1PDE4ACXCR1CXCR2PTGS1
Ibuproxam SCHEMBL10428212 1.00 CHRM1 (1.00) CHRM1PDE4ACXCR1CXCR2PTGS1
Ibuproxam SCHEMBL28086418 0.94 CHRM1 (0.88) CHRM1PDE4ACXCR1CXCR2PTGS1
SCHEMBL6740240 0.89 CHRM1 (0.79) CHRM1PDE4ACXCR1CXCR2PTGS1
SCHEMBL6740243 0.89 CHRM1 (0.79) CHRM1PDE4ACXCR1CXCR2PTGS1
SCHEMBL19953817 0.86 CHRM1 (0.75) CHRM1PDE4ACXCR1CXCR2PTGS1
SCHEMBL3147555 0.86 CHRM1 (0.75) CHRM1PDE4ACXCR1CXCR2PTGS1
SCHEMBL3142734 0.86 CHRM1 (0.75) CHRM1PDE4ACXCR1CXCR2PTGS1
SCHEMBL31006096 0.86 CHRM1 (0.75) CHRM1PDE4ACXCR1CXCR2PTGS1
SCHEMBL23763764 0.84 CHRM1 (0.73) CHRM1PDE4ACXCR1CXCR2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5840714-A ANTIINFLAMMATORY AGENTS FOR STOMACH IRRITATION LEK, TOVARNA FARMACEVTSKIH IN KEMICNIH IZDELKOV, D.D. (SI) 1998-11-24 US claimed
WO-1995007076-A1 INCLUSION COMPLEXES OF RACEMIC IBUPROXAM AND OF OPTICALLY ACTIVE IBUPROXAM WITH CYCLODEXTRIN DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, PHARMACEUTICAL PREPARATIONS CONTAINING THESE INCLUSION COMPLEXES OR CONTAINING OPTICALLY ACTIVE S-(+)-IBUPROXAM, AND USE THEREOF LEK, TOVARNA FARMACEVTSKIH IN KEMIC^¿NIH IZDELKOV, D.D., LJUBLJANA (SI) 1995-03-16 WO claimed
US-5840714-A ANTIINFLAMMATORY AGENTS FOR STOMACH IRRITATION LEK, TOVARNA FARMACEVTSKIH IN KEMICNIH IZDELKOV, D.D. (SI) 1998-11-24 US disclosed
WO-1995007076-A1 INCLUSION COMPLEXES OF RACEMIC IBUPROXAM AND OF OPTICALLY ACTIVE IBUPROXAM WITH CYCLODEXTRIN DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, PHARMACEUTICAL PREPARATIONS CONTAINING THESE INCLUSION COMPLEXES OR CONTAINING OPTICALLY ACTIVE S-(+)-IBUPROXAM, AND USE THEREOF LEK, TOVARNA FARMACEVTSKIH IN KEMIC^¿NIH IZDELKOV, D.D., LJUBLJANA (SI) 1995-03-16 WO disclosed