SCHEMBL19869947

SCHEMBL19869947

COc1cc(S(=O)(=O)NCCN(C)C)c(OC)cc1Br

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.60
PKM P14618 1/20 0.60
GAA P10253 2/20 0.55
HTR2A P28223 1/20 0.50
KMT2A Q03164 1/20 0.49
CYP2C19 P33261 2/20 0.48
CYP2C9 P11712 1/20 0.48
RECQL P46063 1/20 0.48
ALPL P05186 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
GLA P06280 1/20 0.46
CYP1A2 P05177 1/20 0.45
TSHR P16473 1/20 0.45
L3MBTL3 Q96JM7 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
UTS2R Q9UKP6 1/20 0.43
USP2 O75604 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
SCHEMBL19869955 0.82 GAA (0.64) POLBPKMGAAKMT2ACYP2C19
SCHEMBL19869970 0.78 HTR2A (0.51) POLBPKMGAAHTR2AALPL
SCHEMBL13185618 0.77 POLB (0.66) POLBPKMGAAKMT2ACYP2C19
SCHEMBL13167573 0.77 POLB (0.66) POLBPKMGAACYP2C19CYP2C9
SCHEMBL15473866 0.77 POLB (0.62) POLBPKMGAACYP2C19CYP2C9
SCHEMBL19869720 0.75 BRD4 (0.59) POLBPKMGAACYP2C19CYP2C9
SCHEMBL15765533 0.75 PKM (1.00) POLBPKMGAAKDM4EALDH1A1
SCHEMBL24556543 0.73 POLB (0.44) POLBPKMGAACYP2C19CYP2C9
SCHEMBL10745563 0.72 SMN1; SMN2 (0.58) POLBPKMHTR2AKMT2AALDH1A1
SCHEMBL10289139 0.71 GAA (0.55) POLBPKMGAAKMT2ACYP2C19

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 POLB 914/4885PKM 3121/4885GAA 4237/4885
US-11319318-B2 Pyridinones and isoquinolinones as inhibitors of the bromodomain BRD9 BRD9, BRD1, BRD2 POLB 958/4885PKM 2972/4885GAA 4152/4885

“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.