SCHEMBL27765173

SCHEMBL27765173

C=C(C)C(=O)OP(=O)(O)OCCCC(CC)[N+](CCCC)(CCCC)CCCC

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
LPAR3 Q9UBY5 3/20 0.31
LPAR1 Q92633 2/20 0.31
LPAR2 Q9HBW0 2/20 0.31
FABP3 P05413 1/20 0.30
PLA2G2A P14555 1/20 0.30

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
SCHEMBL27765382 0.94 TSHR (0.33) TSHR
SCHEMBL27765491 0.85 TSHR (0.32) TSHR
SCHEMBL27881679 0.80 TSHR (0.47) TSHRLPAR3LPAR1LPAR2
SCHEMBL28325465 0.79 TSHR (0.54) TSHRLPAR3LPAR1LPAR2
SCHEMBL28874094 0.79 TSHR (0.43) TSHRLPAR3LPAR1LPAR2
SCHEMBL25430754 0.78 TSHR (0.57) TSHRLPAR3LPAR1LPAR2
SCHEMBL14992893 0.78 TSHR (0.57) TSHRLPAR3LPAR1LPAR2
SCHEMBL27813919 0.78 TSHR (0.57) TSHRLPAR3LPAR1LPAR2
SCHEMBL27785449 0.78 TSHR (0.57) TSHRLPAR3LPAR1LPAR2
SCHEMBL27834064 0.78 TSHR (0.57) TSHRLPAR3LPAR1LPAR2

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
CN-101466554-A Offset printing plate, offset printing plate material, support for offset printing plate and offset printing method KONICA MINOLTA MEDICAL PRINTIN (JP) 2009-06-24 CN disclosed