SCHEMBL4449142

SCHEMBL4449142

O=P(OC1CC1)(OC1CC1)C(O)O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
INPP5A Q14642 1/20 0.35
ACHE P22303 1/20 0.31

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
SCHEMBL4454142 0.88 NPSR1 (0.53) NPSR1MEN1KMT2ALMNAGAA
SCHEMBL4460748 0.77 NPSR1 (0.37) NPSR1MEN1KMT2ALMNAGAA
SCHEMBL4448534 0.73 NPSR1 (0.35) NPSR1MEN1KMT2ALMNAGAA
SCHEMBL10831669 0.73 NPSR1 (0.53) NPSR1MEN1KMT2ALMNAGAA
SCHEMBL4454070 0.71 NPSR1 (0.33) NPSR1MEN1KMT2ALMNAGAA
SCHEMBL12076280 0.70 NPSR1 (0.58) NPSR1MEN1KMT2ALMNAGAA
SCHEMBL5850409 0.69 INPP5A (0.44) INPP5AACHE
SCHEMBL2238965 0.69
SCHEMBL10832552 0.68 NPSR1 (0.47) NPSR1MEN1KMT2ALMNAGAA
SCHEMBL4450156 0.68 NPSR1 (0.47) NPSR1MEN1KMT2ALMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612148-B2 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2009-11-03 US disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed