SCHEMBL5353882

SCHEMBL5353882

CCC(C)n1ncc2cc(NC[C@@H](O)C(=O)OC)ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 1/20 0.37
▸ KMO O15229 1/20 0.37
▸ HDAC8 Q9BY41 4/20 0.36
▸ MCHR2 Q969V1 1/20 0.36
▸ MCHR1 Q99705 1/20 0.36
▸ P2RX3 P56373 1/20 0.35
▸ HCAR3 P49019 1/20 0.35
▸ MAOB P27338 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ SHMT2 P34897 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP6 Q9GZR1 1/20 0.35
▸ NOTUM Q6P988 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ EZH2 Q15910 1/20 0.33

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
SCHEMBL5353885 1.00 ACLY (0.37) ACLYKMOHDAC8MCHR2MCHR1
SCHEMBL5342410 0.90 ACLY (0.45) ACLYHDAC8MCHR2MCHR1P2RX3
SCHEMBL5342407 0.90 ACLY (0.45) ACLYHDAC8MCHR2MCHR1P2RX3
SCHEMBL5344232 0.83 NOTUM (0.43) MCHR2MCHR1MAOBNPC1RAB9A
SCHEMBL5344229 0.83 NOTUM (0.43) MCHR2MCHR1MAOBNPC1RAB9A
SCHEMBL5347454 0.82 NOTUM (0.49) MAOBNPC1RAB9ANOTUMMAPT
SCHEMBL5347451 0.82 NOTUM (0.49) MAOBNPC1RAB9ANOTUMMAPT
SCHEMBL5999445 0.70 BRD4 (0.39) P2RX3GAA
SCHEMBL5999454 0.70 BRD4 (0.39) P2RX3GAA
SCHEMBL20665050 0.69 KMO (0.53) ACLYKMOHDAC8HCAR3NPC1

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
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