SCHEMBL29613207

SCHEMBL29613207

Cc1ccc(B(O)O)cc1NS(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 3/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
ENPP2 Q13822 1/20 0.43
ATM Q13315 2/20 0.42
POLB P06746 1/20 0.40
BACE1 P56817 2/20 0.39
CSNK2A1 P68400 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 1/20 0.39
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
CECR2 Q9BXF3 1/20 0.38
BRD9 Q9H8M2 1/20 0.38
EP300 Q09472 1/20 0.37

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
SCHEMBL19869868 1.00 NPC1 (0.44) NPC1KMT2AMAPTKEAP1NFE2L2
SCHEMBL392787 0.81 KDM1A (0.45) ENPP2ALDH1A1BRD4
SCHEMBL5183752 0.79 ALDH1A1 (0.48) KMT2AMAPTENPP2BACE1KDM4E
SCHEMBL13842603 0.76 KMT2A (0.51) NPC1KMT2AMAPTKEAP1NFE2L2
SCHEMBL15962148 0.75 MAPK14 (0.47) MAPTKDM4EALDH1A1
SCHEMBL15279864 0.74 ALDH1A1 (0.52) NPC1KMT2AMAPTPOLBALDH1A1
SCHEMBL2336547 0.73 CCNT1 (0.49) NPC1KMT2AMAPTKEAP1NFE2L2
SCHEMBL1688411 0.73 RAPGEF4 (0.49) KMT2AMAPTKEAP1NFE2L2POLB
SCHEMBL1688371 0.73 PLA2G7 (0.49) NPC1KMT2AMAPTKEAP1NFE2L2
SCHEMBL4010773 0.73 ENPP2 (0.52) ENPP2ALDH1A1

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 2 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-11319318-B2 Pyridinones and isoquinolinones as inhibitors of the bromodomain BRD9 BRD9, BRD1, BRD2 NPC1 4315/4885KMT2A 1279/4885MAPT 3152/4885

“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.