SCHEMBL7369010

SCHEMBL7369010

COC(=O)COc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
LMNA P02545 2/20 0.59
ALDH1A1 P00352 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
CYP2C19 P33261 1/20 0.53
MAPK1 P28482 1/20 0.52
NAMPT P43490 1/20 0.52
HTT P42858 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TSHR P16473 1/20 0.52
GPR119 Q8TDV5 5/20 0.50

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
SCHEMBL7360627 0.94 MAPT (0.54) MAPTSMN1; SMN2LMNAALDH1A1L3MBTL1
SCHEMBL22911172 0.93 MAPT (0.58) MAPTSMN1; SMN2LMNAALDH1A1L3MBTL1
SCHEMBL7359036 0.89 MAPT (0.49) MAPTSMN1; SMN2LMNAALDH1A1MAPK1
SCHEMBL12814098 0.88 NPSR1 (0.55) MAPTSMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL7358222 0.87 GPR119 (0.51) MAPTSMN1; SMN2LMNAALDH1A1GPR119
SCHEMBL7360159 0.86 GPR119 (0.53) MAPTSMN1; SMN2LMNAALDH1A1GPR119
SCHEMBL7365688 0.86 GPR119 (0.53) MAPTSMN1; SMN2LMNAALDH1A1GPR119
SCHEMBL7366689 0.86 GPR119 (0.47) MAPTSMN1; SMN2LMNAALDH1A1GPR119
SCHEMBL31716461 0.85 MAPT (0.54) MAPTSMN1; SMN2LMNAALDH1A1L3MBTL1
SCHEMBL24378197 0.85 MAPT (0.61) MAPTSMN1; SMN2LMNAALDH1A1L3MBTL1

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
US-5994356-A ANTICOAGULANT KARL THOMAE (DE) 1999-11-30 US disclosed
EP-0892783-A1 CARBOXYLIC ACID DERIVATIVES WITH AN AGGREGATION-INHIBITING ACTION Dr. Karl Thomae GmbH (DE) 1999-01-27 EP disclosed
WO-1997037975-A1 CARBOXYLIC ACID DERIVATIVES WITH AN AGGREGATION-INHIBITING ACTION DR. KARL THOMAE GMBH (DE) 1997-10-16 WO disclosed