SCHEMBL7364840

SCHEMBL7364840

COC(=O)COc1ccc(N2CCC(C(NCc3ccccc3)C3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.51
TP53 P04637 3/20 0.49
YAP1 P46937 3/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
STS P08842 1/20 0.45
ACHE P22303 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
MMP13 P45452 1/20 0.43

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
Hydrochloric Acid SCHEMBL8478645 0.84 MAPK1 (0.41) TP53MAPTSMN1; SMN2
SCHEMBL7364540 0.82 GPR119 (0.52) GPR119TP53YAP1LMNAMAPT
SCHEMBL8478702 0.81 GPR119 (0.51) GPR119TP53YAP1LMNAMAPT
SCHEMBL8477714 0.79 GPR119 (0.54) GPR119LMNAMAPTSMN1; SMN2
SCHEMBL8477312 0.79 GPR119 (0.48) GPR119TP53YAP1STS
SCHEMBL7369010 0.79 MAPT (0.59) GPR119LMNAMAPTSMN1; SMN2
SCHEMBL7365688 0.79 GPR119 (0.53) GPR119LMNAMAPTSMN1; SMN2
SCHEMBL7360159 0.79 GPR119 (0.53) GPR119LMNAMAPTSMN1; SMN2
SCHEMBL7369003 0.77 GPR119 (0.50) GPR119LMNAMAPTSMN1; SMN2
SCHEMBL8474377 0.77 GPR119 (0.50) GPR119LMNAMAPTSMN1; SMN2

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