SCHEMBL435471

SCHEMBL435471

CCCC(F)[Si](C)(C)OCc1nc2cc3c(cc2c(=O)[nH]1)C(=O)CC3

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 3/20 0.32
RAB9A P51151 1/20 0.32
MAPT P10636 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
PARP14 Q460N5 3/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
USP2 O75604 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL433728 0.85 KDM4E (0.35) KDM4EGAAALDH1A1RAB9AMAPT
SCHEMBL435470 0.80 KDM4E (0.37) KDM4EGAAALDH1A1RAB9AMAPT
SCHEMBL10209810 0.79 LMNA (0.37) KDM4EGAAALDH1A1RAB9AMAPT
SCHEMBL15180116 0.77 TNKS2 (0.49) KDM4EGAAALDH1A1MAPTTDP1
SCHEMBL10209683 0.76 LMNA (0.39) KDM4EGAAALDH1A1RAB9AMAPT
SCHEMBL431949 0.72 MAPT (0.37) KDM4EGAAALDH1A1RAB9AMAPT
SCHEMBL988163 0.72 MAPT (0.38) KDM4EGAAALDH1A1RAB9AMAPT
SCHEMBL459021 0.71 RAB9A (0.45) KDM4EALDH1A1RAB9ATDP1PARP14
SCHEMBL15180105 0.70 LMNA (0.34) KDM4EGAAALDH1A1RAB9AMAPT
SCHEMBL988751 0.68 MAPT (0.38) KDM4EGAAALDH1A1RAB9AMAPT

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-2595966-A2 SYNTHESIS OF CYCLOPENTAQUINAZOLINES Onyx Pharmaceuticals, Inc. (US) 2013-05-29 EP disclosed
WO-2012011939-A2 SYNTHESIS OF CYCLOPENTAQUINAZOLINES ONYX PHARMACEUTICALS, INC. (US) 2012-01-26 WO disclosed