SCHEMBL5342407

SCHEMBL5342407

COC(=O)C(O)CNc1ccc2c(cnn2C(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 1/20 0.45
▸ P2RX3 P56373 1/20 0.42
▸ EZH2 Q15910 1/20 0.41
▸ ABCB1 P08183 1/20 0.41
▸ ABCG2 Q9UNQ0 1/20 0.41
▸ USP36 Q9P275 1/20 0.40
▸ CACNA1H O95180 1/20 0.39
▸ HDAC8 Q9BY41 5/20 0.37
▸ MCHR2 Q969V1 1/20 0.37
▸ MCHR1 Q99705 1/20 0.37
▸ NR3C1 P04150 1/20 0.36
▸ NOTUM Q6P988 1/20 0.36
▸ PDE9A O76083 2/20 0.36
▸ NPC1 O15118 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ SHMT2 P34897 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34

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
SCHEMBL5342410 1.00 ACLY (0.45) ACLYP2RX3EZH2ABCB1ABCG2
SCHEMBL5353882 0.90 ACLY (0.37) ACLYP2RX3EZH2ABCB1ABCG2
SCHEMBL5353885 0.90 ACLY (0.37) ACLYP2RX3EZH2ABCB1ABCG2
SCHEMBL5347454 0.85 NOTUM (0.49) CACNA1HNOTUMNPC1RAB9AMAOB
SCHEMBL5347451 0.85 NOTUM (0.49) CACNA1HNOTUMNPC1RAB9AMAOB
SCHEMBL5344229 0.83 NOTUM (0.43) CACNA1HMCHR2MCHR1NOTUMNPC1
SCHEMBL5344232 0.83 NOTUM (0.43) CACNA1HMCHR2MCHR1NOTUMNPC1
SCHEMBL14566638 0.73 ABCB1 (0.50) ACLYP2RX3EZH2ABCB1ABCG2
SCHEMBL15657915 0.73 EZH2 (0.51) ACLYEZH2USP36CACNA1HHDAC8
SCHEMBL5336933 0.73 ROCK2 (0.49) P2RX3HDAC8NPC1RAB9A

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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