SCHEMBL7148318

SCHEMBL7148318

CCCCCCCCNC1CCCN([S+]([O-])c2ccc(CNC(=O)c3cccc(OC)c3)s2)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
PREP P48147 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
NAMPT P43490 1/20 0.40
CCR3 P51677 1/20 0.40
GRM5 P41594 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HPGD P15428 1/20 0.39
MCHR1 Q99705 1/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
WDR5 P61964 1/20 0.39
RAB9A P51151 1/20 0.38
EPHX2 P34913 1/20 0.38

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
SCHEMBL7145105 0.99 CHRM1 (0.44) CHRM1GAAMAPTPREPALDH1A1
SCHEMBL7143814 0.89 CYP2C9 (0.52) ALDH1A1CCR3CYP2C9CYP2C19HPGD
SCHEMBL7146507 0.88 CYP2C9 (0.47) CHRM1MAPTPREPALDH1A1TSHR
SCHEMBL7145126 0.88 GAA (0.38) CHRM1GAAMAPTPREPALDH1A1
SCHEMBL7148150 0.88 CHRM1 (0.46) CHRM1GAAPREPALDH1A1TSHR
SCHEMBL7145029 0.87 HPGD (0.42) CHRM1GAAPREPALDH1A1TSHR
SCHEMBL7145650 0.85 MEN1 (0.41) CHRM1GAAPREPALDH1A1TSHR
SCHEMBL7144053 0.85 GAA (0.40) CHRM1GAAMAPTPREPALDH1A1
SCHEMBL7145348 0.84 ALDH1A1 (0.42) GAAPREPALDH1A1TSHRHPGD
SCHEMBL7146457 0.84 CHRM1 (0.43) CHRM1PREPALDH1A1TSHRCCR3

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-1322642-A2 sHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES BEARING BOTH LIPOPHILIC AND IONISABLE MOIETIES AS INHIBITORS OF PROTEIN JUNKINASES Applied Research Systems ARS Holding N.V. (AN) 2003-07-02 EP claimed
WO-2002026733-A2 sHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES BEARING BOTH LIPOPHILIC AND IONISABLE MOIETIES AS INHIBITORS OF PROTEIN JUNKINASES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2002-04-04 WO claimed