SCHEMBL4476360

SCHEMBL4476360

O=C1CCCc2ccccc2N1Cc1cccc(Br)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.73
KMT2A Q03164 4/20 0.73
SMN1; SMN2 Q16637 3/20 0.73
CYP1A2 P05177 2/20 0.73
CYP2C9 P11712 2/20 0.73
CYP2C19 P33261 2/20 0.73
GAA P10253 1/20 0.73
POLB P06746 3/20 0.59
LMNA P02545 1/20 0.54
TDP1 Q9NUW8 1/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
KCNN4 O15554 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM5 P08912 1/20 0.43
CHRM1 P11229 1/20 0.43
DRD2 P14416 1/20 0.43
CHRM3 P20309 1/20 0.43

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
SCHEMBL30905277 0.84 POLB (0.82) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL5766288 0.80 SMN1; SMN2 (0.53) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL4477912 0.77 MEN1 (0.63) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL9186295 0.77 MEN1 (0.77) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL29880432 0.75 POLB (1.00) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL10688767 0.75 POLB (1.00) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL15712170 0.74 HDAC1 (0.69) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL4321402 0.74 MEN1 (0.71) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL9190101 0.74 MEN1 (0.76) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL13960741 0.73 MEN1 (0.57) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9

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 10 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
US-7476675-B2 Quinolinone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2009-01-13 US disclosed
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-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 935/4885SMN1; SMN2 3996/4885
US-20050261308-A1 Quinolinone derivatives and uses thereof RECQL, NQO2, QRFPR MEN1 496/4885KMT2A 1510/4885SMN1; SMN2 3556/4885

“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.