SCHEMBL24547736

SCHEMBL24547736

COc1cccc(C(=O)n2c3ccccc3c3c2cnn3C)c1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.52
PARP1 P09874 1/20 0.44
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
HPGD P15428 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
PIK3CA P42336 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CDYL2 Q8N8U2 1/20 0.42
CDYL Q9Y232 1/20 0.42
CDY1; CDY1B Q9Y6F8 1/20 0.42

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
SCHEMBL24547741 0.87 CNR2 (0.49)
SCHEMBL24547742 0.84 P2RX4 (0.56) ELANEHPGD
SCHEMBL24547656 0.84 ELANE (0.46) ELANEPARP1HPGDCES2CES1
SCHEMBL24547657 0.79 LMNA (0.44) ELANEACHEHPGD
SCHEMBL24547632 0.79 P2RX4 (0.43) HPGD
SCHEMBL24547658 0.78 LMNA (0.67) ELANEHPGD
SCHEMBL24547630 0.78 LMNA (0.48) HPGD
SCHEMBL24547738 0.78 HTT (0.48) HPGD
SCHEMBL24547661 0.77 ABCB1 (0.50) ELANEHPGD
SCHEMBL24547737 0.77 LMNA (0.50) ELANEHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067654-A1 OXYTOCIN RECEPTOR MODULATORS Kinoxis Therapeutics Pty Ltd (AU) 2024-02-29 US disclosed
US-20240067654-A1 OXYTOCIN RECEPTOR MODULATORS Kinoxis Therapeutics Pty Ltd (AU) 2024-02-29 US disclosed
WO-2022126179-A1 OXYTOCIN RECEPTOR MODULATORS THE UNIVERSITY OF SYDNEY (AU) 2022-06-23 WO 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-20240067654-A1 OXYTOCIN RECEPTOR MODULATORS OXTR, AVPR1B, AVPR1A ELANE 3651/4885PARP1 4675/4885BCHE 3939/4885

“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.