SCHEMBL19869938

SCHEMBL19869938

COc1cc(Br)cc(OC)c1CN1CCN(C)CC1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.67
KDM4E B2RXH2 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
MTNR1A P48039 1/20 0.44
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
HRH2 P25021 1/20 0.43
DRD3 P35462 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
PGK1 P00558 1/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 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
SCHEMBL19869933 0.82 CYP1A2 (0.50) GAAKDM4ETDP1ALDH1A1
SCHEMBL19869956 0.80 GAA (0.66) GAAKDM4ETDP1ALDH1A1MAPT
SCHEMBL19869945 0.78 GAA (0.63) GAAKDM4ETDP1MTNR1ADRD2
Hydrochloric Acid SCHEMBL4268341 0.76 SMN1; SMN2 (0.48) GAAALDH1A1MEN1POLBKMT2A
SCHEMBL4289837 0.76 CHKA (0.55) GAAKDM4ETDP1ALDH1A1MAPT
SCHEMBL19869942 0.75 BRD4 (0.54) GAAKDM4ETDP1ALDH1A1MEN1
SCHEMBL23783427 0.75 MMP1 (0.47) GAAKDM4EALDH1A1MEN1KMT2A
SCHEMBL2935699 0.74 GAA (0.52) GAAKDM4EALDH1A1MAPTMEN1
SCHEMBL21651001 0.74 POLB (0.57) KDM4EALDH1A1DRD2DRD4HRH2
SCHEMBL28513873 0.74 GAA (0.51) GAAMAPTDRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3265453-B1 NEW PYRIDINONES AND ISOQUINOLINONES AS INHIBITORS OF THE BROMODOMAIN BRD9 BOEHRINGER INGELHEIM INT (DE) 2022-06-29 EP disclosed
US-11319318-B2 Pyridinones and isoquinolinones as inhibitors of the bromodomain BRD9 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-05-03 US disclosed
US-20180044335-A1 New Pyridinones and Isoquinolinones as Inhibitors of the Bromodomain BRD9 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-02-15 US disclosed
US-20180044335-A1 New Pyridinones and Isoquinolinones as Inhibitors of the Bromodomain BRD9 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-02-15 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 (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-20180044335-A1 New Pyridinones and Isoquinolinones as Inhibitors of the Bromodomain BRD9 BRD9, BRD1, BRD2 GAA 4237/4885KDM4E 1154/4885TDP1 1473/4885
US-11319318-B2 Pyridinones and isoquinolinones as inhibitors of the bromodomain BRD9 BRD9, BRD1, BRD2 GAA 4152/4885KDM4E 1262/4885TDP1 1708/4885

“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.