SCHEMBL7606506

SCHEMBL7606506

COc1cc(CC(=O)OC(=O)C2CCCCN2)cc(OC)c1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
KMT2A Q03164 4/20 0.48
MEN1 O00255 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
MAPK1 P28482 1/20 0.47
CYP2C19 P33261 1/20 0.47
KDM4E B2RXH2 2/20 0.44
SIGMAR1 Q99720 1/20 0.44
CCNT1 O60563 1/20 0.43
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
CDK9 P50750 1/20 0.43
CDK5 Q00535 1/20 0.43
CDK5R1 Q15078 1/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42

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
SCHEMBL7618126 1.00 L3MBTL1 (0.52) L3MBTL1KMT2AMEN1SMN1; SMN2CYP1A2
SCHEMBL21241652 0.84 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1SMN1; SMN2CYP1A2
SCHEMBL22861532 0.84 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1SMN1; SMN2CYP1A2
SCHEMBL21241611 0.82 FKBP1A (0.49) L3MBTL1KMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL22861528 0.82 FKBP1A (0.49) L3MBTL1KMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL7612086 0.81 FKBP1A (0.46) L3MBTL1KMT2AMAPK1POLBGAA
SCHEMBL7421496 0.81 FKBP1A (0.46) L3MBTL1KMT2AMAPK1POLBGAA
SCHEMBL11452675 0.80 MAPK1 (0.44) L3MBTL1KMT2AMEN1MAPK1KDM4E
SCHEMBL22861533 0.80 FKBP1A (0.53) L3MBTL1KDM4EALDH1A1
SCHEMBL21241612 0.80 FKBP1A (0.53) L3MBTL1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002522485-A 2002-07-23 JP claimed
EP-1109554-A2 PIPECOLIC ACID DERIVATIVES FOR VISION AND MEMORY DISORDERS GPI NIL Holdings, Inc. (US) 2001-06-27 EP claimed
WO-2000009109-A2 PIPECOLIC ACID DERIVATIVES FOR VISION AND MEMORY DISORDERS GPI NIL HOLDINGS, INC. (US) 2000-02-24 WO claimed
US-5843960-A Inhibitors of rotamase enzyme activity GPI NIL HOLDINGS, INC. (US) 1998-12-01 US claimed
EP-1109554-A2 PIPECOLIC ACID DERIVATIVES FOR VISION AND MEMORY DISORDERS GPI NIL Holdings, Inc. (US) 2001-06-27 EP disclosed
EP-1011650-A1 METHOD FOR PREVENTING AND TREATING HEARING LOSS USING SENSORINEUROTROPHIC COMPOUNDS Amgen Inc., (US) 2000-06-28 EP disclosed
WO-2000009109-A2 PIPECOLIC ACID DERIVATIVES FOR VISION AND MEMORY DISORDERS GPI NIL HOLDINGS, INC. (US) 2000-02-24 WO disclosed
WO-1999014998-A2 METHOD FOR PREVENTING AND TREATING HEARING LOSS USING SENSORINEUROTROPHIC COMPOUNDS AMGEN INC. (US) 1999-04-01 WO disclosed