SCHEMBL4477967

SCHEMBL4477967

CC(C)(C)OC(=O)N1CCN(c2cccc(CN3C(=O)CCCc4ccccc43)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
CYP1A2 P05177 1/20 0.53
GAA P10253 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
DRD2 P14416 5/20 0.44
DRD4 P21917 5/20 0.44
DRD3 P35462 5/20 0.44
NAMPT P43490 1/20 0.43
GPR119 Q8TDV5 3/20 0.43
POLB P06746 2/20 0.43
NPY1R P25929 1/20 0.42
PDK2 Q15119 1/20 0.42
P2RX7 Q99572 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
SCHEMBL4489307 0.83 DRD2 (0.49) MEN1KMT2ACYP2C19SMN1; SMN2DRD2
SCHEMBL13960741 0.80 MEN1 (0.57) MEN1KMT2ACYP1A2GAACYP2C9
SCHEMBL14202129 0.79 MEN1 (0.56) MEN1KMT2ACYP1A2GAACYP2C9
SCHEMBL4477912 0.78 MEN1 (0.63) MEN1KMT2ACYP1A2GAACYP2C9
SCHEMBL671029 0.76 GPR119 (0.57) MEN1KMT2ACYP2C19SMN1; SMN2NAMPT
SCHEMBL7334881 0.76 GPR119 (0.57) MEN1KMT2ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL6011698 0.75 GPR119 (0.56) MEN1KMT2ACYP2C19SMN1; SMN2NAMPT
SCHEMBL22792199 0.75 GPR119 (0.56) MEN1KMT2ACYP2C19SMN1; SMN2NAMPT
SCHEMBL3107402 0.75 GPR119 (0.56) MEN1KMT2ACYP2C19SMN1; SMN2NAMPT
SCHEMBL31709335 0.75 GPR119 (0.56) MEN1KMT2ACYP2C19SMN1; SMN2NAMPT

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
US-7476675-B2 Quinolinone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2009-01-13 US disclosed
EP-1603880-B1 QUINOLINONE/BENZOXAZINONE DERIVATIVES AND USES THEREOF HOFFMANN LA ROCHE (CH) 2008-05-07 EP disclosed
EP-1603880-A1 QUINOLINONE/BENZOXAZINONE DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2005-12-14 EP disclosed
US-20050261308-A1 Quinolinone derivatives and uses thereof ROCHE PALO ALTO LLC 2005-11-24 US disclosed
US-6943169-B2 Quinolinone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2005-09-13 US disclosed
WO-2004080969-A1 QUINOLINONE / BENZOXAZINONE DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2004-09-23 WO disclosed
US-20040186092-A1 Quinolinone derivaties and uses thereof ROCHE PALO ALTO LLC 2004-09-23 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 (2 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-20040186092-A1 Quinolinone derivaties and uses thereof NQO2, UGT1A8, UGT1A1 MEN1 433/4885KMT2A 935/4885CYP1A2 39/4885
US-20050261308-A1 Quinolinone derivatives and uses thereof RECQL, NQO2, QRFPR MEN1 496/4885KMT2A 1510/4885CYP1A2 38/4885

“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.