SCHEMBL24547747

SCHEMBL24547747

Cn1ncc2c3ccccc3n(C(=O)I)c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
HPGD P15428 4/20 0.43
LMNA P02545 4/20 0.43
HTT P42858 3/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 4/20 0.40
KDM4E B2RXH2 3/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 3/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
P2RX4 Q99571 1/20 0.37
TFPI2 P48307 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL21330598 0.82 P2RX4 (0.53) POLBHPGDLMNAHTTMAPK1
SCHEMBL24547678 0.78 ELANE (0.42) POLBHPGDLMNAHTTMAPK1
SCHEMBL27112822 0.75 ELANE (0.46) HPGDLMNAHTTMAPK1KDM4E
SCHEMBL24547744 0.67 KDM4E (0.45) POLBHPGDLMNAHTTMAPK1
SCHEMBL20139098 0.66 LMNA (0.55) LMNAKDM4EMAPTCYP1A2CYP2C9
SCHEMBL21330594 0.66 P2RX4 (0.54) HPGDLMNAHTTMAPTALDH1A1
SCHEMBL24547648 0.66 ALDH1A1 (0.47) POLBHPGDLMNAHTTHSD17B10
SCHEMBL24547742 0.65 P2RX4 (0.56) HPGDLMNAHTTMAPK1HSD17B10
SCHEMBL153365 0.65 POLB (1.00) POLBHPGDLMNAHTTHSD17B10
SCHEMBL29787117 0.65 POLB (1.00) POLBHPGDLMNAHTTHSD17B10

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
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 POLB 3897/4885HPGD 564/4885LMNA 2876/4885

“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.