SCHEMBL9028971

SCHEMBL9028971

COc1cc(C(=O)N2CC(O)CC2C(N)=O)cc(OC)c1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 2/20 0.44
CYP1A2 P05177 1/20 0.44
MMP2 P08253 4/20 0.44
ANPEP P15144 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41
TUBA3E Q6PEY2 1/20 0.41
TUBA1A Q71U36 1/20 0.41
TUBA1C Q9BQE3 1/20 0.41
TUBB6 Q9BUF5 1/20 0.41

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
SCHEMBL9029658 0.88 MMP2 (0.56) GAAPOLBALDH1A1CYP1A2MMP2
SCHEMBL9028374 0.88 MMP2 (0.56) GAAPOLBALDH1A1CYP1A2MMP2
SCHEMBL9028843 0.87 MMP2 (0.50) POLBALDH1A1CYP1A2MMP2ANPEP
SCHEMBL21697319 0.87 MMP2 (0.50) POLBALDH1A1CYP1A2MMP2ANPEP
SCHEMBL9028847 0.87 MMP2 (0.50) POLBALDH1A1CYP1A2MMP2ANPEP
SCHEMBL9308374 0.87 MMP2 (0.58) GAAPOLBALDH1A1CYP1A2MMP2
SCHEMBL19505987 0.87 MMP2 (0.58) GAAPOLBALDH1A1CYP1A2MMP2
SCHEMBL9027922 0.83 MEN1 (0.48) ALDH1A1MMP2ANPEPMEN1KMT2A
SCHEMBL9027917 0.83 MEN1 (0.48) ALDH1A1MMP2ANPEPMEN1KMT2A
SCHEMBL9028379 0.79 ALDH1A1 (0.46) GAAPOLBALDH1A1CYP1A2MMP2

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
EP-0486386-B1 Novel derivatives of N-benzoylproline, process for their preparation and drugs containing them ADIR (FR) 1996-07-17 EP disclosed
US-5332735-A Antiamnesic activity ADIR ET COMPAGNIE (FR) 1994-07-26 US disclosed
EP-0486386-A2 Novel derivatives of N-benzoylproline, process for their preparation and drugs containing them ADIR ET COMPAGNIE (FR) 1992-05-20 EP disclosed