SCHEMBL7066889

SCHEMBL7066889

CCCCCCCCOC(=O)C(I)CCI

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.48
EPHX1 P07099 1/20 0.46
ESR1 P03372 2/20 0.45
AKR1C4 P17516 1/20 0.45
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
AKR1C1 Q04828 1/20 0.45
TSHR P16473 2/20 0.44
HCAR2 Q8TDS4 1/20 0.42
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FAAH O00519 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
SCHEMBL7971345 0.93 NAAA (0.48) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL7067966 0.93 ALDH1A1 (0.47) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL7973579 0.90 NAAA (0.46) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL21811481 0.89 NAAA (0.52) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL21811482 0.89 NAAA (0.52) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL21811669 0.89 NAAA (0.52) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL21811520 0.89 NAAA (0.52) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL21811516 0.89 NAAA (0.52) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL21811449 0.89 NAAA (0.52) NAAAEPHX1ESR1AKR1C4AKR1C3
SCHEMBL21811608 0.87 NAAA (0.48) NAAAEPHX1ESR1AKR1C4AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0827954-B1 Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL CO (JP) 2003-06-04 EP disclosed
US-6114543-A Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-09-05 US disclosed
US-5880291-A Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-03-09 US disclosed
EP-0827954-A1 Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-03-11 EP disclosed