SCHEMBL16562005

SCHEMBL16562005

C=CC(=O)NCCCC(=O)NCCCCCCOP(=O)(O)OC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
TSHR P16473 1/20 0.43
LPAR1 Q92633 3/20 0.40
LPAR2 Q9HBW0 2/20 0.40
ENPP2 Q13822 1/20 0.40
TGM2 P21980 2/20 0.36
CASP2 P42575 1/20 0.35
TERT O14746 1/20 0.35
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
PLA2G4A P47712 2/20 0.34
PLCD1 P51178 1/20 0.34
LPAR3 Q9UBY5 2/20 0.34
CNR1 P21554 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
SCHEMBL16562009 0.97 ZDHHC20 (0.46) ZDHHC20ZDHHC2TSHRLPAR1LPAR2
SCHEMBL17636271 0.92 ZDHHC20 (0.53) ZDHHC20ZDHHC2TSHRLPAR1LPAR2
SCHEMBL16639382 0.83 TSHR (0.57) TSHRLPAR1LPAR2ENPP2CASP2
SCHEMBL21204263 0.82 LPAR1 (0.55) TSHRLPAR1LPAR2ENPP2CASP2
SCHEMBL21204352 0.82 LPAR1 (0.55) TSHRLPAR1LPAR2ENPP2CASP2
SCHEMBL24429214 0.82 LPAR1 (0.55) TSHRLPAR1LPAR2ENPP2CASP2
SCHEMBL21204364 0.82 LPAR1 (0.55) TSHRLPAR1LPAR2ENPP2CASP2
SCHEMBL23451136 0.82 TSHR (0.47) TSHRLPAR1LPAR2ENPP2CASP2
SCHEMBL19931551 0.82 TSHR (0.47) TSHRLPAR1LPAR2ENPP2CASP2
SCHEMBL16640196 0.82 TSHR (0.51) TSHRLPAR1LPAR2ENPP2CASP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150072351-A1 HIGH-SENSITIVITY NUCLEIC ACID PREPARATION METHODS FOR THE DETECTION OF NUCLEIC ACID BY NUCLEIC ACID POLYMERASE BIONEER CORPORATION (KR) 2015-03-12 US disclosed