SCHEMBL20198667

SCHEMBL20198667

CC(C)N(CI)CCC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 6/20 0.37
KDM4A O75164 5/20 0.37
PHF8 Q9UPP1 4/20 0.37
KDM2A Q9Y2K7 4/20 0.37
GABRP O00591 2/20 0.37
GABRD O14764 2/20 0.37
GABRA1 P14867 2/20 0.37
GABRB1 P18505 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37
GABRA3 P34903 2/20 0.37
GABRA2 P47869 2/20 0.37
GABRB2 P47870 2/20 0.37
GABRA4 P48169 2/20 0.37
GABRE P78334 2/20 0.37
GABRA6 Q16445 2/20 0.37
GABRG1 Q8N1C3 2/20 0.37
GABRG3 Q99928 2/20 0.37
GABRQ Q9UN88 2/20 0.37

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
SCHEMBL4247084 0.86 GABRP (0.42) KDM4CKDM4APHF8KDM2AGABRP
SCHEMBL3195705 0.80 ALDH1A1 (0.42) KDM4CKDM4APHF8KDM2AGABRP
SCHEMBL26209746 0.80 TDP1 (0.39) KDM4CKDM4APHF8KDM2AGABRP
SCHEMBL10246717 0.78 KDM4C (0.44) KDM4CKDM4APHF8KDM2AGABRP
SCHEMBL3187223 0.78 FFAR3 (0.44) KDM4CFFAR3HDAC3HDAC1HDAC2
SCHEMBL12269098 0.78 CAMK2A (0.37) KDM4CKDM4APHF8KDM2AGABRP
SCHEMBL11212413 0.78 GABRP (0.41) KDM4CKDM4APHF8KDM2AGABRP
SCHEMBL23693497 0.77 KDM4C (0.47) KDM4CKDM4APHF8KDM2AGABRP
SCHEMBL26724520 0.77 LMNA (0.41) KDM4CKDM4APHF8KDM2AGABRP
SCHEMBL11342740 0.75 AKR1B1 (0.46) KDM4CPHF8ALDH1A1KDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2923692-B1 Beta-amino ester compounds and uses thereof LIVING PROOF INC (US) 2018-05-30 EP disclosed