SCHEMBL5742279

SCHEMBL5742279

O=C(O)CCN(Cc1ccccc1)C(=O)C1(c2c(Cc3ccccc3)oc3ccccc23)C=CC(c2ccccc2)=CC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.38
MTNR1B P49286 2/20 0.38
PTPN1 P18031 15/20 0.36
PTPRF P10586 1/20 0.33
PTPRA P18433 1/20 0.33
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
FFAR2 O15552 2/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL4264218 0.80 MTNR1A (0.40) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL4800199 0.80 PTPN1 (0.38) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL4806726 0.79 PTPN1 (0.38) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL5768014 0.77 PTPN1 (0.40) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL5742273 0.75 PTPN1 (0.39) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL5187438 0.71 PTPN1 (0.39) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL4274375 0.70 ADAMTS4 (0.36) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL4267609 0.70 PTPN1 (0.47) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL4261640 0.69 PTPN1 (0.38) MTNR1AMTNR1BPTPN1PTPRFPTPRA
SCHEMBL5743849 0.69 TAS2R14 (0.35) MTNR1AMTNR1BPTPN1DUSP3

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 3 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