SCHEMBL11559728

SCHEMBL11559728

COc1ccc2c(c1)NC(CN1C(=O)CCC1=O)C(C)(C)O2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.37
▸ HIF1A Q16665 2/20 0.36
▸ HTR2A P28223 1/20 0.35
▸ PGR P06401 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ GLA P06280 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ POLB P06746 2/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ABCB1 P08183 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KCNH2 Q12809 1/20 0.33
▸ PPIB P23284 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ TSHR P16473 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
SCHEMBL11557429 0.85 MMP12 (0.38) GAAALDH1A1KDM4EPOLBMAPT
SCHEMBL11558220 0.84 KCNE1 (0.34) HIF1APGR
SCHEMBL11558080 0.84 MAPT (0.36) GAAALDH1A1KDM4EMAPTKMT2A
SCHEMBL11560192 0.84 LMNA (0.38) PGRNPSR1SMN1; SMN2
SCHEMBL11558077 0.84 ATAD2 (0.38) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL11560034 0.81 SMN1; SMN2 (0.37) GAAALDH1A1KDM4EPOLBHPGD
SCHEMBL11559426 0.81 TRPV1 (0.35) KCNH2MEN1KMT2A
SCHEMBL11565708 0.81 PTGS2 (0.34) KCNH2L3MBTL1
SCHEMBL11560946 0.81 ALPL (0.34) GAAALDH1A1KDM4EPOLBNPSR1
SCHEMBL11560739 0.78 NQO2 (0.40) ALDH1A1KDM4EPOLBNPSR1HPGD

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
US-4134974-A Imidazo[5,1-c][1,4]benzoxazin-1-one CARLO ERBA S. P. A. (IT) 1979-01-16 — — US disclosed
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