SCHEMBL4776880

SCHEMBL4776880

CCOC(=O)[C@H]1CC[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 2/20 0.39
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 4/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 1/20 0.34
HSD17B10 Q99714 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
PIK3CD O00329 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
P2RX3 P56373 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
KLK7 P49862 1/20 0.32
CYP1A2 P05177 1/20 0.31
POLB P06746 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
SCHEMBL2197772 0.91 P2RX3 (0.37) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL23008569 0.91 P2RX3 (0.37) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL18612435 0.91 P2RX3 (0.37) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL28579733 0.88 NR1H2 (0.36) FKBP1AALDH1A1HSD17B10P2RX3CYP1A2
SCHEMBL25217657 0.88 NR1H2 (0.36) FKBP1AALDH1A1HSD17B10P2RX3CYP1A2
SCHEMBL5133260 0.86 FKBP1A (0.41) FKBP1AMEN1KMT2AALDH1A1MAPT
SCHEMBL25273988 0.85 HSD17B10 (0.39) ALDH1A1HSD17B10CYP1A2POLBCYP3A4
SCHEMBL25273987 0.85 HSD17B10 (0.39) ALDH1A1HSD17B10CYP1A2POLBCYP3A4
SCHEMBL5133262 0.83 RAB9A (0.37) FKBP1AALDH1A1MAPTHSD17B10GAA
SCHEMBL706992 0.80 ALDH1A1 (0.34) MEN1KMT2AALDH1A1TSHRHSD17B10

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-1891078-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2006125974-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2006-11-30 WO disclosed