SCHEMBL16331123

SCHEMBL16331123

CCOC(=O)c1nc(C(=O)OCc2ccccc2)cn1COCC[Si](C)(C)C

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.61
GABRA2 P47869 5/20 0.42
GABRB2 P47870 5/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
F2RL3 Q96RI0 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL13733884 0.85 DGAT1 (0.43) DGAT1GABRA2GABRB2ALDH1A1GAA
SCHEMBL13733546 0.84 DGAT1 (0.61) DGAT1ALDH1A1LMNATSHRMAPK1
SCHEMBL30824981 0.83 DGAT1 (0.45) DGAT1ALDH1A1LMNANPC1RAB9A
SCHEMBL19780512 0.82 DGAT1 (0.60) DGAT1ALDH1A1LMNATSHRMAPK1
SCHEMBL16661173 0.82 DGAT1 (0.69) DGAT1GABRA2GABRB2ALDH1A1NPC1
SCHEMBL19780156 0.82 DGAT1 (0.59) DGAT1ALDH1A1LMNATSHRMAPK1
SCHEMBL13734316 0.81 DGAT1 (0.58) DGAT1ALDH1A1TSHRMAPK1KMT2A
SCHEMBL20531461 0.80 DGAT1 (0.57) DGAT1ALDH1A1LMNATSHRMAPK1
SCHEMBL19780155 0.80 DGAT1 (0.57) DGAT1ALDH1A1LMNATSHRMAPK1
SCHEMBL15293975 0.80 DGAT1 (0.77) DGAT1GABRA2GABRB2ALDH1A1KMT2A

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-2699561-B1 ANDROGEN RECEPTOR MODULATING CARBOXAMIDES ORION CORP (FI) 2015-06-03 EP disclosed
US-8921378-B2 Androgen receptor modulating carboxamides ORION CORPORATION (FI) 2014-12-30 US disclosed