SCHEMBL7008724

SCHEMBL7008724

CS(=O)(=O)c1ccc(CC(=O)NCCCCCC(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.58
TRPV1 Q8NER1 5/20 0.50
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA5A P35218 1/20 0.47
CA7 P43166 1/20 0.47
CA5B Q9Y2D0 1/20 0.47
HPGD P15428 2/20 0.47
MAPK1 P28482 1/20 0.47
TBXA2R P21731 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 2/20 0.46
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
KMT2A Q03164 1/20 0.44

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
SCHEMBL5656019 0.81 ATM (0.87) ATMTRPV1HPGDMAPK1ALDH1A1
SCHEMBL6349089 0.81 ATM (0.87) ATMTRPV1HPGDMAPK1ALDH1A1
SCHEMBL24969912 0.81 ATM (0.61) ATMTRPV1HPGDMAPK1GAA
SCHEMBL7340100 0.81 ITGB3 (0.63) ALDH1A1GAATSHR
SCHEMBL9830686 0.80 ATM (0.65) ATMTRPV1CA1CA2HPGD
SCHEMBL9828506 0.80 ATM (0.65) ATMTRPV1HPGDMAPK1GAA
SCHEMBL9829797 0.80 ATM (0.69) ATMTRPV1CA2HPGDMAPK1
SCHEMBL7598913 0.80 ATM (0.60) ATMALDH1A1
SCHEMBL4363116 0.80 HDAC1 (0.64) ATMTRPV1
SCHEMBL30783469 0.80 ATM (0.60) ATMTRPV1HPGDMAPK1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0988296-B1 NAPHTHOTHIAZOLONE DERIVATIVES ACTIVE ON THE D 3 DOPAMINERGIC RECEPTOR ZAMBON SPA (IT) 2003-01-08 EP disclosed
EP-0781126-B1 DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRO-NAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON SPA (IT) 2001-12-12 EP disclosed
US-6232348-B1 AGONISTS OF THE DOPAMINERGIC RECEPTORS MORE POTENT THAN DOPAMINE AND OTHER KNOWN COMPOUNDS, DEPRIVED OF INTERACTION WITH OTHER RECEPTORS AND ORALLY BIOAVAILABLE WITH A LONG TERM OF ACTION ZAMBON GROUP S.P.A. (IT) 2001-05-15 US disclosed
US-6107318-A PSYCHOLOGICAL DISORDERS ZAMBON GROUP S.P.A. (IT) 2000-08-22 US disclosed
EP-0988296-A1 NAPHTHOTHIAZOLONE DERIVATIVES ACTIVE ON THE D 3 DOPAMINERGIC RECEPTOR ZAMBON GROUP S.p.A. (IT) 2000-03-29 EP disclosed
EP-0966423-A1 HYDROXYMETHYL DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE AS CARDIOVASCULAR AGENT ZAMBON GROUP S.p.A. (IT) 1999-12-29 EP disclosed
WO-1998056778-A1 NAPHTHOTHIAZOLONE DERIVATIVES ACTIVE ON THE D3 DOPAMINERGIC RECEPTOR ZAMBON GROUP S.P.A. (IT) 1998-12-17 WO disclosed
WO-1998038154-A1 HYDROXYMETHYL DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE AS CARDIOVASCULAR AGENT ZAMBON GROUP S.P.A. (IT) 1998-09-03 WO disclosed