SCHEMBL6930707

SCHEMBL6930707

CCCC(=O)N(c1ccccc1Oc1ccccc1)[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.43
TSPO P30536 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 3/20 0.38
POLB P06746 1/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
MTNR1B P49286 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SLC1A5 Q15758 1/20 0.35

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
SCHEMBL757884 0.80 TP53 (0.48) SMN1; SMN2LMNAALDH1A1TSHR
SCHEMBL6535237 0.71 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1POLBLMNAMAPT
SCHEMBL7342248 0.68 ALDH1A1 (0.40) SMN1; SMN2L3MBTL1POLBLMNAMAPT
SCHEMBL7342254 0.68 ALDH1A1 (0.40) SMN1; SMN2L3MBTL1POLBLMNAMAPT
SCHEMBL28294340 0.67 KMT2A (0.40) SMN1; SMN2L3MBTL1POLBLMNAMAPT
SCHEMBL18116316 0.67 TSPO (0.53) TSPOL3MBTL1POLBLMNA
SCHEMBL7345170 0.67 MMP2 (0.40) SMN1; SMN2L3MBTL1POLBLMNAMAPT
SCHEMBL8429495 0.67 LMNA (0.39) SMN1; SMN2L3MBTL1POLBLMNAMAPT
SCHEMBL8429588 0.67 LMNA (0.39) SMN1; SMN2L3MBTL1POLBLMNAMAPT
SCHEMBL6464595 0.67 ALDH1A1 (0.39) SMN1; SMN2L3MBTL1POLBLMNAMAPT

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-1363876-A1 GLUCOCORTICOID RECEPTOR MODULATORS Abbott Laboratories (US) 2003-11-26 EP claimed
WO-2002064550-A1 GLUCOCORTICOID RECEPTOR MODULATORS ABBOTT LABORATORIES (US) 2002-08-22 WO claimed