SCHEMBL1972152

SCHEMBL1972152

CCC[C@@](N)(C(=O)O)c1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
CYP1A2 P05177 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 2/20 0.47
KIF11 P52732 4/20 0.46
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
LMNA P02545 1/20 0.43
ALOX15 P16050 1/20 0.43
APEX1 P27695 1/20 0.43
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MMP9 P14780 1/20 0.43
MMP13 P45452 1/20 0.43
KCNH2 Q12809 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
PARP1 P09874 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
SCHEMBL1970323 0.87 MEN1 (0.65) MEN1CYP1A2KMT2AALDH1A1KIF11
SCHEMBL1968659 0.87 MEN1 (0.65) MEN1CYP1A2KMT2AALDH1A1KIF11
SCHEMBL1478852 0.81 CYP1A2 (0.51) MEN1CYP1A2KMT2AKIF11LMNA
SCHEMBL8079775 0.80 ALDH1A1 (0.49) CYP1A2ALDH1A1KIF11CA1CA2
SCHEMBL4878584 0.76 ALDH1A1 (0.49) MEN1KMT2AALDH1A1KIF11CA1
SCHEMBL8775713 0.75 KIF11 (0.47) KMT2AALDH1A1KIF11MMP13
SCHEMBL8086879 0.74 ALDH1A1 (0.47) ALDH1A1KIF11CA1CA2LMNA
SCHEMBL3491598 0.74 MAPT (0.50) CYP1A2ALDH1A1KIF11CA1CA2
SCHEMBL2910709 0.74 MAPT (0.50) CYP1A2ALDH1A1KIF11CA1CA2
SCHEMBL3492765 0.74 MAPT (0.50) CYP1A2ALDH1A1KIF11CA1CA2

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
US-8168667-B2 Imidazolidine derivatives, uses therefor, preparation thereof and compositions comprising such GALAPAGOS NV (BE) 2012-05-01 US disclosed
EP-2026799-B1 IMIDAZOLIDINE DERIVATIVES, USES THEREFOR, PREPARATION THEREOF AND COMPOSITIONS COMPRISING SUCH GALAPAGOS SAS (FR) 2011-06-22 EP disclosed