SCHEMBL5742826

SCHEMBL5742826

O=C(O)CNS(=O)(=O)C1(c2c(Cc3ccccc3)oc3ccccc23)C=CC(c2ccccc2)=CC1F

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.38
MTNR1B P49286 2/20 0.38
PTPN1 P18031 16/20 0.35
MMP8 P22894 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
MAPT P10636 1/20 0.33
PTPRF P10586 1/20 0.33
PTPRA P18433 1/20 0.33
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33

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
SCHEMBL4264638 0.87 MMP2 (0.42) MTNR1AMTNR1BPTPN1MMP13PTPRF
SCHEMBL5744959 0.85 MTNR1A (0.36) MTNR1AMTNR1BPTPN1MMP13MAPT
SCHEMBL4275279 0.80 PTPN1 (0.36) MTNR1AMTNR1BPTPN1MMP13PTPRF
SCHEMBL4263457 0.69 PTPN1 (0.39) MTNR1AMTNR1BPTPN1MMP13PTPRF
SCHEMBL4275242 0.69 MMP2 (0.40) MTNR1AMTNR1BPTPN1MMP13PTPRF
SCHEMBL4265268 0.67 MMP2 (0.39) MTNR1AMTNR1BPTPN1MMP13PTPRF
SCHEMBL4261640 0.67 PTPN1 (0.38) MTNR1AMTNR1BPTPN1MMP12MMP13
SCHEMBL4264218 0.66 MTNR1A (0.40) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL4462938 0.65 PTPN1 (0.60) PTPN1MMP12PTPRFPTPRAPTPN7
SCHEMBL5742279 0.64 MTNR1A (0.38) MTNR1AMTNR1BPTPN1MAPTPTPRF

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
JP-2006525365-A 2006-11-09 JP claimed
EP-1620422-A2 PHENYL SUBSTITUTED CARBOXYLIC ACIDS AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 EP claimed
WO-2004099170-A2 PHENYL SUBSTITUTED CARBOXYLIC ACIDS AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 WO claimed
EP-1620422-A2 PHENYL SUBSTITUTED CARBOXYLIC ACIDS AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 EP disclosed
WO-2004099170-A2 PHENYL SUBSTITUTED CARBOXYLIC ACIDS AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE-1B THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 WO disclosed