SCHEMBL8016087

SCHEMBL8016087

COc1ccc(S(=O)(=O)N(CCC(=O)N2CCC(C(=O)O)CC2)CC(=O)N(O)C2CCCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.49
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CAMK2A Q9UQM7 3/20 0.48
CAMK2G Q13555 1/20 0.48
MMP3 P08254 2/20 0.47
MEP1B Q16820 1/20 0.45
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR7 P34969 1/20 0.44
TAS2R14 Q9NYV8 1/20 0.43
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
GAA P10253 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
KEAP1 Q14145 2/20 0.42

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
Water SCHEMBL8018794 0.99 TSHR (0.49) TSHRPOLBSMN1; SMN2CAMK2ACAMK2G
SCHEMBL8003306 0.91 TSHR (0.55) TSHRPOLBSMN1; SMN2HTTGAA
SCHEMBL27540154 0.90 MMP3 (0.48) TSHRPOLBSMN1; SMN2CAMK2ACAMK2G
SCHEMBL8014840 0.83 MMP3 (0.46) TSHRPOLBSMN1; SMN2CAMK2ACAMK2G
SCHEMBL8014852 0.77 MMP3 (0.48) CAMK2ACAMK2GMMP3MEP1BHTR2A
SCHEMBL8008082 0.76 PTGES (0.47) CAMK2ACAMK2GMMP3MEP1BHTR2A
SCHEMBL8016090 0.75 BMP1 (0.49) TSHRPOLBSMN1; SMN2CAMK2ACAMK2G
Water SCHEMBL8018798 0.74 BMP1 (0.49) TSHRPOLBSMN1; SMN2CAMK2ACAMK2G
SCHEMBL8015014 0.74 BMP1 (0.54) MMP3
SCHEMBL27562106 0.73 CAMK2A (0.45) TSHRPOLBSMN1; SMN2CAMK2ACAMK2G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0922030-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1999-06-16 EP claimed
WO-1998007697-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1998-02-26 WO claimed
US-6153609-A Arylsulfonylamino hydroxamic acid derivatives PFIZER INC (US) 2000-11-28 US disclosed
EP-0922030-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1999-06-16 EP disclosed
WO-1998007697-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1998-02-26 WO disclosed