SCHEMBL4476855

SCHEMBL4476855

BrCc1cc(Br)cc2c1OCCO2

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
BLM P54132 1/20 0.40
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
LARS1 Q9P2J5 2/20 0.33
AHR P35869 2/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MAOB P27338 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
MTNR1A P48039 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ESR1 P03372 1/20 0.30

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
SCHEMBL4064131 0.86 AHR (0.34) AHRMAOBALOX15ALOX12
SCHEMBL1137474 0.79 KDM4E (0.35) MEN1KMT2ALARS1HPGDNPSR1
SCHEMBL8148986 0.76 MAPT (0.35) MAPTNPSR1
SCHEMBL19125254 0.74 SLC5A2 (0.38) MAPTLMNAHTTBLMMEN1
SCHEMBL16595637 0.72 LMNA (0.42) MAPTLMNAHTTBLMMEN1
SCHEMBL4180857 0.72 MAPT (0.42) MAPTLMNAHTTBLMMEN1
SCHEMBL15988846 0.72 ALOX15 (0.50) MAPTLMNAHTTBLMMEN1
SCHEMBL13534207 0.72 LMNA (0.42) MAPTLMNAHTTBLMMEN1
SCHEMBL3333977 0.72 LMNA (0.42) MAPTLMNAHTTBLMMEN1
SCHEMBL31038320 0.72 LMNA (0.42) MAPTLMNAHTTBLMMEN1

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 6 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-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 MAPT 4044/4885LMNA 817/4885HTT 2885/4885
US-20050261308-A1 Quinolinone derivatives and uses thereof RECQL, NQO2, QRFPR MAPT 4354/4885LMNA 1069/4885HTT 2809/4885

“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.