SCHEMBL13255605

SCHEMBL13255605

CCOC(=O)c1cc(C(=O)N(C)C)c2cc(Cc3ccc(F)cc3)cnc2c1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MAPT P10636 4/20 0.38
KDM4E B2RXH2 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE4B Q07343 1/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
GRM7 Q14831 1/20 0.37
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.36
ALOX12 P18054 1/20 0.36
CCR6 P51684 1/20 0.36
HKDC1 Q2TB90 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
DPP4 P27487 1/20 0.36

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
SCHEMBL13255607 0.89 MEN1 (0.42) MEN1KMT2AMAPTKDM4ENPSR1
SCHEMBL13255606 0.89 MAPT (0.39) MEN1KMT2AMAPTKDM4ENPSR1
SCHEMBL13255610 0.88 GRM2 (0.37) NPSR1MAOB
SCHEMBL13255419 0.88 MEN1 (0.41) MEN1KMT2AMAPTKDM4ENPSR1
SCHEMBL13255533 0.86 PDE3B (0.46) MEN1KMT2AMAPTKDM4ENPSR1
SCHEMBL13255616 0.86 GRM2 (0.37) KDM4EGAA
SCHEMBL13255515 0.85 MEN1 (0.40) MEN1KMT2AMAPTKDM4ENPSR1
SCHEMBL13255400 0.85 MEN1 (0.40) MEN1KMT2AMAPTKDM4ENPSR1
SCHEMBL13255615 0.85 GRM2 (0.42) LMNAHTT
SCHEMBL13255521 0.83 L3MBTL1 (0.43) MEN1KMT2AKDM4ENPSR1ALDH1A1

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-7759372-B2 Nitrogen-containing heteroaryl compounds having inhibitory activity against HIV integrase SHIONOGI & CO., LTD. (JP) 2010-07-20 US disclosed