SCHEMBL8915536

SCHEMBL8915536

CNCC(CCC(=O)O)NC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.64
ENPEP Q07075 1/20 0.64
GABRP O00591 2/20 0.41
GABRD O14764 2/20 0.41
GABRA1 P14867 2/20 0.41
GABRB1 P18505 2/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRA3 P34903 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 2/20 0.41
GABRA4 P48169 2/20 0.41
GABRE P78334 2/20 0.41
GABRA6 Q16445 2/20 0.41
GABRG1 Q8N1C3 2/20 0.41
GABRG3 Q99928 2/20 0.41
GABRQ Q9UN88 2/20 0.41
CYP1A2 P05177 2/20 0.41
PLA2G2C Q5R387 2/20 0.40

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
SCHEMBL26347202 0.86 ANPEP (0.83) ANPEPENPEPGABRPGABRDGABRA1
SCHEMBL3402756 0.84 ANPEP (0.47) ANPEPENPEPPLA2G2C
SCHEMBL24839201 0.81 ANPEP (0.42) ANPEPENPEP
SCHEMBL6447114 0.80 ANPEP (0.67) ANPEPENPEPGABRPGABRDGABRA1
SCHEMBL16710258 0.80 ANPEP (0.67) ANPEPENPEPGABRPGABRDGABRA1
SCHEMBL25943327 0.78 ANPEP (0.70) ANPEPENPEPGABRPGABRDGABRA1
SCHEMBL16768817 0.78 ANPEP (0.70) ANPEPENPEPGABRPGABRDGABRA1
SCHEMBL26639415 0.78 ANPEP (0.64) ANPEPENPEPGABRPGABRDGABRA1
SCHEMBL26639409 0.78 ANPEP (0.64) ANPEPENPEPGABRPGABRDGABRA1
Hydrochloric Acid SCHEMBL4169104 0.78 ANPEP (0.64) ANPEPENPEPGABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5625075-A Metal radionuclide chelating compounds for improved chelation kinetics NEORX CORPORATION (US) 1997-04-29 US disclosed
US-5436352-A Metal radionuclide chelating compounds for improved chelation kinetics NEORX CORPORATION (US) 1995-07-25 US disclosed
EP-0344724-B1 METAL RADIONUCLIDE CHELATING COMPOUNDS FOR IMPROVED CHELATION KINETICS NEORX CORPORATION (US) 1993-08-11 EP disclosed
US-5075099-A Metal radionuclide chelating compounds for improved chelation kinetics NEORX CORPORATION (US) 1991-12-24 US disclosed
US-4988496-A Metal radionuclide chelating compounds for improved chelation kinetics NEORX CORPORATION (US) 1991-01-29 US disclosed
EP-0344724-A2 Metal radionuclide chelating compounds for improved chelation kinetics NEORX CORPORATION (US) 1989-12-06 EP disclosed