SCHEMBL2909738

SCHEMBL2909738

N[C@@H]1C=C[C@H](OC(=O)O)C1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABAT P80404 1/20 0.39
GABRR1 P24046 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL6822256 1.00 ABAT (0.39) ABATGABRR1TSHRMAPK1HSD17B10
SCHEMBL7092335 1.00 ABAT (0.39) ABATGABRR1TSHRMAPK1HSD17B10
Hydrochloric Acid SCHEMBL6386772 0.98 ABAT (0.38) ABATGABRR1
SCHEMBL13722120 0.81 CA12 (0.40) ABATTSHR
SCHEMBL11430747 0.81 CA12 (0.40) ABATTSHR
SCHEMBL18606378 0.81 CA12 (0.40) ABATTSHR
SCHEMBL15018519 0.76 ABAT (0.32) ABAT
SCHEMBL6821414 0.71 SMN1; SMN2 (0.34)
SCHEMBL15748000 0.71
SCHEMBL15750317 0.68 SLC6A4 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0590685-B1 Process for optical resolution of (+)-cis-4-aminocyclopent-2-en-1-carboxylic acid derivative KURARAY CO (JP) 1996-05-29 EP claimed
EP-1657243-B1 Procedure for the production of amino alcohols LONZA AG (CH) 2010-08-18 EP disclosed
EP-1982985-A2 Method for manufacturing a purine derivative Lonza AG (CH) 2008-10-22 EP disclosed
EP-1508565-B1 Process for the preparation of optically active aminoalcohols LONZA AG (CH) 2008-08-13 EP disclosed
EP-1418170-B1 Process for the preparation of optically active amino alcohols by optical resolution LONZA AG (CH) 2006-06-07 EP disclosed
EP-1657243-A1 Procedure for the production of amino alcohols Lonza AG (CH) 2006-05-17 EP disclosed
EP-1508565-A1 Process for the preparation of optically active aminoalcohols Lonza AG (CH) 2005-02-23 EP disclosed
EP-0904348-B1 PROCESS FOR THE PREPARATION OF AMINO ALCOHOLS AND DERIVATIVES THEREOF LONZA AG (CH) 2004-11-24 EP disclosed
EP-1418170-A2 Process for the preparation of optically active amino alcohols by optical resolution Lonza AG (CH) 2004-05-12 EP disclosed
EP-0926131-B1 Process for the preparation of 1-amino-4-(hydroxymethyl)-2-cyclopentene LONZA AG (CH) 2004-02-11 EP disclosed
EP-1095160-B1 METHOD FOR PRODUCING (1R,4S)-2-AZABICYCLO 2.2.1 HEPT-5-EN-3-ON DERIVATIVES. LONZA AG (CH) 2004-01-28 EP disclosed
EP-0926131-A2 Process for the preparation of aminoalcohol derivatives and their further transformation zu (1R,4S)-4-((2-amino-6-chlor-5-formamido-4-pyrimidinyl)-amino)-2-cyclopenten-1-methanol LONZA A.G. (CH) 1999-06-30 EP disclosed