SCHEMBL2264210

SCHEMBL2264210

CC(C)(C)OC(=O)N1CCN(C(=O)c2cc[c]cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.66
MEN1 O00255 2/20 0.66
HDAC4 P56524 1/20 0.53
ABL1 P00519 1/20 0.52
RIN1 Q13671 1/20 0.52
POLB P06746 1/20 0.51
EPHX2 P34913 1/20 0.51
GPR119 Q8TDV5 4/20 0.48
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
CRBN Q96SW2 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
USP2 O75604 1/20 0.46
CNR2 P34972 1/20 0.46
SETD7 Q8WTS6 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL8252454 0.86 KMT2A (0.72) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL1374093 0.86 MEN1 (0.68) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL5537347 0.84 KMT2A (0.70) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL3960220 0.84 MEN1 (0.66) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL29188760 0.84 KMT2A (0.70) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL3900270 0.84 KMT2A (0.70) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL110336 0.83 KMT2A (0.68) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL2365799 0.83 KMT2A (0.68) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL3093877 0.83 MEN1 (0.68) KMT2AMEN1HDAC4ABL1RIN1
SCHEMBL1256025 0.83 KMT2A (0.92) KMT2AMEN1HDAC4ABL1RIN1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1465869-B1 MODULATORS OF LXR EXELIXIS PATENT CO LLC (US) 2013-05-15 EP claimed
US-7998986-B2 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US claimed
US-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS, INC. 2003-09-25 US claimed
CN-105492008-A Novel compounds and compositions for inhibition of fasn FORMA THERAPEUTICS INC 2016-04-13 CN disclosed
EP-1465869-B1 MODULATORS OF LXR EXELIXIS PATENT CO LLC (US) 2013-05-15 EP disclosed
US-7998986-B2 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
US-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS, INC. 2003-09-25 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-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors NR1H2, NR1H3, NCOA1 KMT2A 1794/4885MEN1 4405/4885HDAC4 784/4885

“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.