SCHEMBL10319219

SCHEMBL10319219

CCN1C=CN(CC)C1OP(=O)(O)O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 1/20 0.33
ITPR3 Q14573 7/20 0.32
ITPR2 Q14571 3/20 0.32
ITPR1 Q14643 3/20 0.32
INPP5A Q14642 1/20 0.31
INPPL1 O15357 1/20 0.31
AKT1 P31749 1/20 0.31
PDPK1 O15530 1/20 0.30
MTOR P42345 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
SCHEMBL2030113 0.89
SCHEMBL14717357 0.74 CYP3A4 (0.52)
SCHEMBL5449036 0.73 LPAR3 (0.33) SMPD1
SCHEMBL552537 0.71 TSHR (0.39)
SCHEMBL14717185 0.71
SCHEMBL14738666 0.71
SCHEMBL14717428 0.70 CYP3A4 (0.38)
SCHEMBL14717407 0.69
SCHEMBL14717518 0.68 CYP3A4 (0.36)
Phosphoric Acid SCHEMBL29257053 0.65

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
EP-4157912-A1 COMPOSITIONS CONTAINING URETDIONE GROUPS CROSSLINKING AT LOW TEMPERATURES Covestro Deutschland AG (DE) 2023-04-05 EP disclosed
WO-2021239678-A1 COMPOSITIONS CONTAINING URETDIONE GROUPS CROSSLINKING AT LOW TEMPERATURES COVESTRO DEUTSCHLAND AG (DE) 2021-12-02 WO disclosed
US-20120180475-A1 ACTUATOR AND SHEET-SHAPED ACTUATOR UNIVERSITY OF YAMANASHI (JP) 2012-07-19 US disclosed