SCHEMBL9558236

SCHEMBL9558236

CC(OC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.64
YAP1 P46937 3/20 0.60
KMT2A Q03164 5/20 0.58
GPR119 Q8TDV5 1/20 0.56
ACE P12821 1/20 0.51
ATM Q13315 2/20 0.51
MEN1 O00255 2/20 0.49
POLB P06746 2/20 0.49
MAPT P10636 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GPR55 Q9Y2T6 1/20 0.49
STS P08842 1/20 0.49
LMNA P02545 1/20 0.49
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL22834245 0.86 MAPK1 (0.64) MAPK1YAP1KMT2AGPR119MEN1
SCHEMBL22834248 0.86 MAPK1 (0.64) MAPK1YAP1KMT2AGPR119MEN1
SCHEMBL9558140 0.85 MAPK1 (0.58) MAPK1YAP1KMT2AACEATM
SCHEMBL6165579 0.84 MAPK1 (0.75) MAPK1YAP1KMT2AATMMEN1
SCHEMBL6165580 0.84 MAPK1 (0.75) MAPK1YAP1KMT2AATMMEN1
SCHEMBL9558243 0.83 YAP1 (0.64) MAPK1YAP1KMT2AACEATM
SCHEMBL7276592 0.81 POLB (0.65) MAPK1YAP1KMT2AACEPOLB
SCHEMBL7276597 0.81 POLB (0.65) MAPK1YAP1KMT2AACEPOLB
SCHEMBL22834076 0.81 MAPK1 (0.58) MAPK1YAP1KMT2AGPR119MEN1
SCHEMBL22834077 0.81 MAPK1 (0.58) MAPK1YAP1KMT2AGPR119MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5215968-A Hypotension agents and viricides HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-01 US disclosed
EP-0373497-A2 Dipeptide derivatives with an enzyme-inhibiting activity HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-20 EP disclosed