SCHEMBL19869965

SCHEMBL19869965

COc1cc(Br)ccc1S(=O)(=O)N1CCN(C)CC1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.62
MAPT P10636 1/20 0.62
ALDH1A1 P00352 6/20 0.59
SMN1; SMN2 Q16637 1/20 0.58
L3MBTL1 Q9Y468 3/20 0.57
MCOLN3 Q8TDD5 1/20 0.55
ALK Q9UM73 1/20 0.54
USP2 O75604 1/20 0.51
KMT2A Q03164 1/20 0.51
TSHR P16473 3/20 0.51
NPBWR1 P48145 1/20 0.50

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
SCHEMBL15052377 0.89 GAA (0.79) GAAMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL1156581 0.84 ADRA2A (0.50) GAAMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL10568810 0.83 MAPT (0.62) GAAMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL19869948 0.81 TSHR (0.76) GAAMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL1156054 0.81 L3MBTL1 (0.65) GAAALDH1A1SMN1; SMN2L3MBTL1KMT2A
SCHEMBL4244000 0.81 L3MBTL1 (0.64) GAAMAPTALDH1A1L3MBTL1KMT2A
SCHEMBL19869960 0.80 TGM2 (0.65) GAAMAPTALDH1A1SMN1; SMN2MCOLN3
SCHEMBL2933388 0.79 L3MBTL1 (0.50) GAAMAPTALDH1A1L3MBTL1KMT2A
SCHEMBL19869952 0.79 ALDH1A1 (0.57) GAAALDH1A1SMN1; SMN2MCOLN3TSHR
SCHEMBL10572672 0.79 ALDH1A1 (0.60) MAPTALDH1A1SMN1; SMN2L3MBTL1MCOLN3

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 4237/4885MAPT 3164/4885ALDH1A1 2654/4885
US-11319318-B2 Pyridinones and isoquinolinones as inhibitors of the bromodomain BRD9 BRD9, BRD1, BRD2 GAA 4152/4885MAPT 3152/4885ALDH1A1 2461/4885

“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.