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Sugi Predict / Compounds / SCHEMBL11233751

SCHEMBL11233751

SCHEMBL11233751

O=P(O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC1C(O)C(O)C(O)C(O)C1OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ITPR3 Q14573 9/20 0.60
▸ ITPR1 Q14643 5/20 0.60
▸ ITPR2 Q14571 4/20 0.60
▸ INPP5A Q14642 2/20 0.52
▸ INPPL1 O15357 1/20 0.46
▸ AKT1 P31749 1/20 0.46
▸ SMPD1 P17405 1/20 0.44

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
SCHEMBL7171543 1.00 ITPR3 (0.60) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL14992390 0.98 ITPR3 (0.61) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL5056860 0.96 ITPR3 (0.68) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL1356398 0.96 ITPR3 (0.54) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL7117013 0.96 ITPR3 (0.54) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL462454 0.96 ITPR3 (0.54) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL1322462 0.96 ITPR3 (0.54) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL9165530 0.96 ITPR3 (0.54) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL639515 0.96 ITPR3 (0.54) ITPR3ITPR1ITPR2INPP5AINPPL1
SCHEMBL133218 0.96 ITPR3 (0.54) ITPR3ITPR1ITPR2INPP5AINPPL1

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-4341558-A ZIRCONIUM OR TITANIUM COMPOUND, SILICA, INOSITOL POLYPHOSPHATE, CORROSION RESISTANCE, PAINT RECEPITIVITY HOOKER CHEMICALS & PLASTICS CORP. (US) 1982-07-27 — — US disclosed