SCHEMBL3106300

SCHEMBL3106300

CC(CCO)CN1CCOCC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.52
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 3/20 0.45
ANPEP P15144 1/20 0.42
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
HIF1A Q16665 1/20 0.37
CYP2D6 P10635 1/20 0.36

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
SCHEMBL3089306 0.89 USP2 (0.48) USP2ALDH1A1KDM4EANPEPLMNA
SCHEMBL12014355 0.86 USP2 (0.50) USP2ALDH1A1KDM4EANPEPLMNA
SCHEMBL12014359 0.84 USP2 (0.44) USP2ALDH1A1KDM4EANPEPLMNA
SCHEMBL31323718 0.83 USP2 (0.56) USP2ALDH1A1KDM4EANPEPLMNA
SCHEMBL31396800 0.83 USP2 (0.56) USP2ALDH1A1KDM4EANPEPLMNA
SCHEMBL3101596 0.83 USP2 (0.56) USP2ALDH1A1KDM4EANPEPLMNA
SCHEMBL17828102 0.83 USP2 (0.58) USP2ALDH1A1KDM4EANPEPLMNA
SCHEMBL3106242 0.82 ALDH1A1 (0.53) USP2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL10721371 0.82 USP2 (0.48) USP2ALDH1A1KDM4EANPEPLMNA
SCHEMBL17393324 0.80 USP2 (0.47) USP2ALDH1A1KDM4EANPEPLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2204394-B1 PROCESS FOR PRODUCTION OF POLYESTER-CONTAINING FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION FOR USE IN THE PROCESS TOSOH CORP (JP) 2017-07-12 EP disclosed
US-8980965-B2 Method for producing polyester type flexible polyurethane foam, and catalyst composition to be used therefor TOSOH CORPORATION (JP) 2015-03-17 US disclosed
CN-101835820-B Process for production of polyester-containing flexible polyurethane foam, and catalyst composition for use in the process TOSOH CORP 2012-11-21 CN disclosed
US-20100256249-A1 METHOD FOR PRODUCING POLYESTER TYPE FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION TO BE USED THEREFOR TOSOH CORPORATION (JP) 2010-10-07 US disclosed
CN-101835820-A Process for production of polyester-containing flexible polyurethane foam, and catalyst composition for use in the process TOSOH CORP 2010-09-15 CN disclosed
EP-2204394-A1 PROCESS FOR PRODUCTION OF POLYESTER-CONTAINING FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION FOR USE IN THE PROCESS Tosoh Corporation (JP) 2010-07-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100256249-A1 METHOD FOR PRODUCING POLYESTER TYPE FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION TO BE USED THEREFOR OR51E2, CYP4F11, FFAR3 USP2 784/4885ALDH1A1 2369/4885KDM4E 2947/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.