SCHEMBL10076568

SCHEMBL10076568

CCOC(=O)CN(C)Cc1cccc(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
MAPT P10636 2/20 0.49
ACHE P22303 1/20 0.49
KDM4E B2RXH2 1/20 0.49
LTA4H P09960 1/20 0.46
HSP90AA1 P07900 1/20 0.43
MEP1B Q16820 1/20 0.43
MEN1 O00255 3/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.41
NPC1 O15118 1/20 0.41
JAK2 O60674 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL413698 0.86 SMN1; SMN2 (0.47) KMT2AALDH1A1SMN1; SMN2MAPTACHE
SCHEMBL8337648 0.84 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2MAPTACHEKDM4E
SCHEMBL10053129 0.83 MEN1 (0.46) KMT2AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL10232316 0.83 MEP1B (0.50) KMT2AALDH1A1MAPTACHELTA4H
SCHEMBL10076814 0.81 CD274 (0.51) KMT2AALDH1A1SMN1; SMN2ACHEKDM4E
SCHEMBL14432416 0.80 ACHE (0.52) KMT2ASMN1; SMN2ACHEHSP90AA1MEN1
SCHEMBL14648417 0.79 HSP90AA1 (0.51) KMT2AALDH1A1SMN1; SMN2ACHEHSP90AA1
SCHEMBL13222646 0.78 SMN1; SMN2 (0.50) KMT2AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL1107143 0.78 KMT2A (0.56) KMT2AALDH1A1SMN1; SMN2MEN1HPGD
SCHEMBL29852285 0.77 CHRNB2 (0.60) KMT2AALDH1A1SMN1; SMN2MAPTKDM4E

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
US-8106031-B2 Hydrolytically-resistant boron-containing therapeutics and methods of use ANACOR PHARMACEUTICALS, INC. (US) 2012-01-31 US disclosed
US-20070265226-A1 Hydrolytically-Resistant Boron-Containing Therapeutics And Methods Of Use ANACOR PHARMACEUTICALS (US) 2007-11-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070265226-A1 Hydrolytically-Resistant Boron-Containing Therapeutics And Methods Of Use GAA, BTD, MANBA KMT2A 2279/4885ALDH1A1 2088/4885SMN1; SMN2 1509/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.