SCHEMBL4645233

SCHEMBL4645233

O=C(CCCO)Oc1cc(O)cc(O)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 3/20 0.44
CNR1 P21554 8/20 0.43
CNR2 P34972 8/20 0.43
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HSP90AB1 P08238 1/20 0.36
MEN1 O00255 1/20 0.35
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 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
SCHEMBL4641728 0.94 VCAM1 (0.46) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8654408 0.90 KMT2A (0.48) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8651557 0.90 KMT2A (0.44) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8651624 0.88 KMT2A (0.47) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8653229 0.88 KMT2A (0.47) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8652802 0.88 KMT2A (0.47) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8653636 0.88 KMT2A (0.47) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8653228 0.88 KMT2A (0.47) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8655657 0.88 KMT2A (0.47) VCAM1CNR1CNR2KMT2AMAPT
SCHEMBL8650698 0.88 KMT2A (0.47) VCAM1CNR1CNR2KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed