SCHEMBL3398233

SCHEMBL3398233

NC(=O)OC1(O)CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
CYP2C19 P33261 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
USP2 O75604 1/20 0.31
CYP1A2 P05177 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 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
SCHEMBL22660781 0.87
SCHEMBL4019607 0.79 CYP2C19 (0.33) TSHRCYP2C19SMN1; SMN2ALDH1A1
SCHEMBL28787467 0.79 SMN1; SMN2 (0.35) TSHRCYP2C19SMN1; SMN2ALDH1A1
SCHEMBL4360209 0.77 CYP2C19 (0.34) TSHRCYP2C19SMN1; SMN2ALDH1A1LMNA
SCHEMBL28515873 0.76 KDM4E (0.41)
SCHEMBL4225849 0.75 SMN1; SMN2 (0.33) TSHRCYP2C19SMN1; SMN2ALDH1A1
SCHEMBL27683933 0.75 SMN1; SMN2 (0.33) TSHRCYP2C19SMN1; SMN2ALDH1A1
SCHEMBL1935525 0.75 TSHR (0.36) TSHRCYP2C19SMN1; SMN2ALDH1A1LMNA
SCHEMBL27683921 0.75 SMN1; SMN2 (0.33) TSHRCYP2C19SMN1; SMN2ALDH1A1
SCHEMBL24095445 0.73 CYP19A1 (0.42) TSHRCYP2C19SMN1; SMN2ALDH1A1LMNA

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
CN-102105496-A Method of making carbamate functional materials BASF CORP 2011-06-22 CN claimed
EP-2197921-A1 METHOD OF MAKING CARBAMATE FUNCTIONAL MATERIALS BASF Coatings GmbH (US) 2010-06-23 EP claimed
WO-2009035667-A1 METHOD OF MAKING CARBAMATE FUNCTIONAL MATERIALS BASF CORPORATION (US) 2009-03-19 WO claimed
CN-102105496-A Method of making carbamate functional materials BASF CORP 2011-06-22 CN disclosed
EP-2197921-A1 METHOD OF MAKING CARBAMATE FUNCTIONAL MATERIALS BASF Coatings GmbH (US) 2010-06-23 EP disclosed
WO-2009035667-A1 METHOD OF MAKING CARBAMATE FUNCTIONAL MATERIALS BASF CORPORATION (US) 2009-03-19 WO disclosed