SCHEMBL2436490

SCHEMBL2436490

OB(O)c1cccc(Br)c1.OB(O)c1ccccc1Cl

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.42
ENPP2 Q13822 6/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TTR P02766 2/20 0.39
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
TSHR P16473 1/20 0.35
LPL P06858 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
MAPK1 P28482 1/20 0.34

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
SCHEMBL73569 0.82 ENPP2 (0.56) MGLLENPP2ALDH1A1KDM4ECA4
SCHEMBL4129 0.78 TSHR (0.47) ENPP2ALDH1A1CA4CA6CA5A
SCHEMBL29404220 0.78 TSHR (0.47) ENPP2ALDH1A1CA4CA6CA5A
SCHEMBL911579 0.77 ENPP2 (0.59) MGLLENPP2ALDH1A1KDM4ETTR
Benzene SCHEMBL28042388 0.75 LMNA (0.45) MGLLENPP2ALDH1A1CA4CA6
SCHEMBL28117905 0.75 TSHR (0.45) ENPP2ALDH1A1CA4CA6CA5A
SCHEMBL20953849 0.75 ENPP2 (0.40) MGLLENPP2TTRCA4CA6
SCHEMBL2436493 0.75 MGLL (0.47) MGLLENPP2ALDH1A1KDM4ECA4
Formic Acid SCHEMBL28096019 0.73 ENPP2 (0.47) MGLLENPP2ALDH1A1KDM4ECA4
SCHEMBL30085260 0.71 MGLL (0.67) MGLLENPP2ALDH1A1KDM4ECA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2756067-A1 MICROCAPSULE COMPOSITIONS COMPRISING PH TUNEABLE DI-AMIDO GELLANTS The Procter & Gamble Company (US) 2014-07-23 EP disclosed
WO-2013039963-A1 MICROCAPSULE COMPOSITIONS COMPRISING PH TUNEABLE DI-AMIDO GELLANTS THE PROCTER & GAMBLE COMPANY (US) 2013-03-21 WO disclosed
WO-2011112910-A1 LIQUID DETERGENT COMPOSITIONS COMPRISING PH TUNEABLE AMIDO-GELLANTS, AND PROCESSES FOR MAKING THE PROCTER & GAMBLE COMPANY (US) 2011-09-15 WO disclosed
WO-2011112886-A1 FLUID DETERGENT COMPOSITIONS COMPRISING A DI-AMIDO GELLANT, AND PROCESSES FOR MAKING THE PROCTER & GAMBLE COMPANY (US) 2011-09-15 WO disclosed