SCHEMBL7701636

SCHEMBL7701636

CCN(O)[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.45
TET2 Q6N021 3/20 0.41
KDM4A O75164 2/20 0.41
KDM4C Q9H3R0 2/20 0.41
KDM2A Q9Y2K7 2/20 0.41
TET3 O43151 1/20 0.41
FOLH1 Q04609 9/20 0.40
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40
GABRE P78334 2/20 0.40
GABRA6 Q16445 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
SCHEMBL4655463 1.00 CYP1A2 (0.45) CYP1A2TET2KDM4AKDM4CKDM2A
SCHEMBL1221384 0.84 ALOX15 (0.45) GRIK1SLC1A3SLC1A2SLC1A1GRIK2
SCHEMBL3335954 0.84 ALOX15 (0.45) GRIK1SLC1A3SLC1A2SLC1A1GRIK2
SCHEMBL2639593 0.84 CYP1A2 (0.42) CYP1A2TET2KDM4AKDM4CKDM2A
SCHEMBL1286830 0.84 CYP1A2 (0.42) CYP1A2TET2KDM4AKDM4CKDM2A
D-Glutamate SCHEMBL8219041 0.84 ALOX15 (0.56) CYP1A2FOLH1GABRPGABRDGABRA1
SCHEMBL6992803 0.81 CYP1A2 (0.46) CYP1A2TET2KDM4AKDM4CKDM2A
SCHEMBL6311082 0.81 CYP1A2 (0.46) CYP1A2TET2KDM4AKDM4CKDM2A
SCHEMBL313183 0.79 FOLH1 (0.36) FOLH1GRIK1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL573426 0.79 CYP1A2 (0.45) CYP1A2TET2KDM4AKDM4CKDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189971-A2 FUNCTIONAL POLY-ALPHA-AMINOACID DERIVATIVES USEFUL FOR THE MODIFICATION OF BIOLOGICALLY ACTIVE MATERIALS AND THEIR APPLICATION UNIVERSITEIT GENT (BE) 2002-03-27 EP disclosed
WO-2000078791-A2 FUNCTIONAL POLY-α-AMINOACID DERIVATIVES USEFUL FOR THE MODIFICATION OF BIOLOGICALLY ACTIVE MATERIALS AND THEIR APPLICATION UNIVERSITEIT GENT (BE) 2000-12-28 WO disclosed