SCHEMBL29613191

SCHEMBL29613191

COc1cccc2c(=O)n(C)ccc12

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
TP53 P04637 4/20 0.52
POLB P06746 2/20 0.52
MTNR1A P48039 1/20 0.50
MTNR1B P49286 1/20 0.50
MAPT P10636 4/20 0.49
KDM4E B2RXH2 7/20 0.49
ALDH1A1 P00352 6/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
TSHR P16473 2/20 0.49
HPGD P15428 1/20 0.49
LMNA P02545 2/20 0.47
CYP2C9 P11712 1/20 0.47
MAPK1 P28482 1/20 0.47
P2RX7 Q99572 1/20 0.46

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
SCHEMBL9394915 1.00 GAA (0.53) GAATP53POLBMTNR1AMTNR1B
SCHEMBL18799544 0.81 MAPT (0.57) GAATP53POLBMTNR1AMTNR1B
SCHEMBL9393331 0.78 KDM4E (0.59) TP53MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL15957895 0.77 TP53 (0.55) GAATP53POLBMTNR1AMTNR1B
SCHEMBL3783034 0.76 MTNR1A (0.48) GAATP53POLBMTNR1AMTNR1B
SCHEMBL13833580 0.76 GAA (0.57) GAATP53POLBMAPTALDH1A1
SCHEMBL31116611 0.76 CA1 (0.61) TP53MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL357145 0.76 CA1 (0.61) TP53MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL347727 0.76 RHEB (0.62) POLBMAPTKDM4EALDH1A1TSHR
SCHEMBL29989576 0.76 RHEB (0.62) POLBMAPTKDM4EALDH1A1TSHR

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 GAA 4152/4885TP53 471/4885POLB 958/4885

“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.