SCHEMBL8803583

SCHEMBL8803583

Cc1ccc(NC(=O)CN2C(=O)c3ccccc3C2=O)c(C)c1CC(O[SiH](c1ccccc1)c1ccccc1)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.46
MEN1 O00255 6/20 0.42
POLB P06746 2/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
THRB P10828 1/20 0.39
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL6639732 0.84 KMT2A (0.45) KMT2AMEN1POLBTSHRMAPT
SCHEMBL6639724 0.75 MAPT (0.44) KMT2AMEN1POLBTSHRMAPT
SCHEMBL6642424 0.74 KMT2A (0.44) KMT2AMEN1POLBTSHRMAPT
SCHEMBL6645642 0.74 MAPT (0.43) KMT2AMEN1MAPTALDH1A1THRB
SCHEMBL8803569 0.72 MAPT (0.43) KMT2AMEN1POLBTSHRMAPT
SCHEMBL8803577 0.69 KMT2A (0.47) KMT2AMEN1POLBTSHRMAPT
SCHEMBL9135817 0.68 POLB (0.69) KMT2AMEN1POLBTSHRMAPT
SCHEMBL6640574 0.67 KMT2A (0.40) KMT2AMEN1POLBTSHRMAPT
SCHEMBL4179176 0.66 KMT2A (0.60) KMT2AMEN1POLBTSHRMAPT
SCHEMBL6646929 0.66 GAA (0.52) KMT2AMEN1POLBMAPTALDH1A1

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
EP-0807105-A1 PYRIDOPYRIMIDONES, QUINOLINES AND FUSED N-HERETOCYCLES AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-11-19 EP disclosed