SCHEMBL5355190

SCHEMBL5355190

COC(=O)[C@H]1CN(c2ccc3c(cnn3C)c2)C(=O)O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE1C Q14123 2/20 0.42
CYP11B2 P19099 1/20 0.39
BRD4 O60885 1/20 0.37
CREBBP Q92793 1/20 0.37
PTGER3 P43115 1/20 0.37
KDM2B Q8NHM5 1/20 0.37
MAOA P21397 4/20 0.36
TRPA1 O75762 1/20 0.36
MMP2 P08253 1/20 0.36
GLRA3 O75311 1/20 0.36
GLRB P48167 1/20 0.36
MAOB P27338 4/20 0.36
ACHE P22303 1/20 0.36
NOTUM Q6P988 1/20 0.36
CCNC P24863 1/20 0.35
CDK8 P49336 1/20 0.35
GRM2 Q14416 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 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
SCHEMBL5355186 1.00 PDE1C (0.42) PDE1CCYP11B2BRD4CREBBPPTGER3
SCHEMBL5341457 0.89 PDE1C (0.35) PDE1CCYP11B2BRD4CREBBPPTGER3
SCHEMBL5337231 0.88 MAOA (0.47) PDE1CCYP11B2BRD4CREBBPPTGER3
SCHEMBL5337225 0.88 MAOA (0.47) PDE1CCYP11B2BRD4CREBBPPTGER3
SCHEMBL5345629 0.87 CYP11B2 (0.39) PDE1CCYP11B2BRD4CREBBPPTGER3
SCHEMBL5345634 0.87 CYP11B2 (0.39) PDE1CCYP11B2BRD4CREBBPPTGER3
SCHEMBL5346074 0.86 GRM2 (0.37) PTGER3MAOAMAOBGRM2
SCHEMBL5338264 0.86 BRD4 (0.40) BRD4CREBBPPTGER3MAOAMAOB
SCHEMBL5346078 0.86 GRM2 (0.37) PTGER3MAOAMAOBGRM2
SCHEMBL5338261 0.86 BRD4 (0.40) BRD4CREBBPPTGER3MAOAMAOB

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
WO-2007088478-A1 INDAZOLE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PFIZER PRODUCTS INC. (US) 2007-08-09 WO disclosed