SCHEMBL9218787

SCHEMBL9218787

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

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.37
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
THRB P10828 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL3351984 0.84 FDPS (0.38) FDPSLMNAHSD17B10
SCHEMBL11680689 0.84 FDPS (0.44) FDPS
SCHEMBL3833063 0.81 MEN1 (0.35) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL2138066 0.81 CYP2D6 (0.44) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL6038124 0.81 LMNA (0.36) FDPSLMNA
SCHEMBL10926903 0.80 KMT2A (0.36) FDPSLMNAHSD17B10MEN1ALDH1A1
SCHEMBL2448745 0.80 FFAR3 (0.38) FDPSLMNAHSD17B10MEN1ALDH1A1
SCHEMBL29025723 0.78 KDM4C (0.37) FDPSLMNAHSD17B10MEN1ALDH1A1
SCHEMBL9179083 0.78 KDM4C (0.37) FDPSLMNAHSD17B10MEN1ALDH1A1
SCHEMBL28440778 0.76 CYP2D6 (0.44) MEN1ALDH1A1CYP1A2THRBKMT2A

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-0681580-A1 PRODRUGS OF ANTIINFLAMMATORY 3-ACYL-2-OXINDOLE-1-CARBOXAMIDES. PFIZER HOSPITAL PROD (US) 1995-11-15 EP disclosed
WO-1994017061-A1 PRODRUGS OF ANTIINFLAMMATORY 3-ACYL-2-OXINDOLE-1-CARBOXAMIDES PFIZER INC. (US) 1994-08-04 WO disclosed