SCHEMBL8901401

SCHEMBL8901401

CC1N(CC(=O)O)C=CN1CC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 2/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
SLC6A9 P48067 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
FFAR3 O14843 1/20 0.30
APEX1 P27695 1/20 0.30
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL13758008 0.87
SCHEMBL9437108 0.82
SCHEMBL11065703 0.65 SMN1; SMN2 (0.34) LMNAALDH1A1KDM4EPOLBMAPT
SCHEMBL16143253 0.64 ALDH1A1 (0.42) LMNAALDH1A1KDM4EPOLBMAPT
SCHEMBL16143324 0.64 ALDH1A1 (0.42) LMNAALDH1A1KDM4EPOLBMAPT
SCHEMBL16143254 0.64 ALDH1A1 (0.42) LMNAALDH1A1KDM4EPOLBMAPT
SCHEMBL27753236 0.62 FFAR3 (0.35) ALDH1A1MEN1KMT2AFFAR3
SCHEMBL3906770 0.62
SCHEMBL24481894 0.60 SLC6A9 (0.49) SLC6A9
SCHEMBL22693278 0.60 FUCA1 (0.38) FFAR3CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0458901-B1 INHIBITING TRANSFORMATION OF CELLS HAVING ELEVATED PURINE METABOLIC ENZYME ACTIVITY MASSACHUSETTS INST TECHNOLOGY (US) 1997-12-17 EP disclosed
EP-0758681-A2 Inhibiting transformation of cells having elevated purine metabolic enzyme activity MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1997-02-19 EP disclosed
US-5324731-A Method of inhibiting transformation of cells in which purine metabolic enzyme activity is elevated AMIRA, INC. (US) 1994-06-28 US disclosed
EP-0557383-A1 METHOD OF INHIBITING TRANSFORMATION, GROWTH AND METASTASIS OF CELLS IN WHICH PURINE METABOLIC ENZYME ACTIVITY IS ELEVATED AMIRA, INC. (US) 1993-09-01 EP disclosed
WO-1992008456-A2 METHOD OF INHIBITING TRANSFORMATION, GROWTH AND METASTASIS OF CELLS IN WHICH PURINE METABOLIC ENZYME ACTIVITY IS ELEVATED AMIRA, INC. (US) 1992-05-29 WO disclosed
EP-0458901-A1 INHIBITING TRANSFORMATION OF CELLS HAVING ELEVATED PURINE METABOLIC ENZYME ACTIVITY MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1991-12-04 EP disclosed
WO-1990009192-A1 INHIBITING TRANSFORMATION OF CELLS HAVING ELEVATED PURINE METABOLIC ENZYME ACTIVITY MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1990-08-23 WO disclosed