SCHEMBL24547686

SCHEMBL24547686

Cn1ncc2c1c1cc(F)ccc1n2C(=O)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.40
SMO Q99835 1/20 0.39
RORC P51449 1/20 0.36
KDM2B Q8NHM5 1/20 0.36
KDM4C Q9H3R0 2/20 0.36
KDM5A P29375 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTR2C P28335 1/20 0.35
PARG Q86W56 1/20 0.35
ADORA1 P30542 1/20 0.35
ATM Q13315 1/20 0.35
GRM5 P41594 3/20 0.35
PLK1 P53350 1/20 0.35
HTR3A P46098 2/20 0.34
CNR1 P21554 1/20 0.34
IDO1 P14902 1/20 0.34

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
SCHEMBL24547743 0.91 HSD11B1 (0.38) HSD11B1SMORORCKDM2BALDH1A1
SCHEMBL24547660 0.83 ELANE (0.45) ALDH1A1
SCHEMBL24547757 0.83 ELANE (0.45) ALDH1A1
SCHEMBL24547758 0.82 ELANE (0.46) ALDH1A1
SCHEMBL24547762 0.72 HSD17B10 (0.41) ALDH1A1CNR1
SCHEMBL24547633 0.70 RIPK1 (0.38) ALDH1A1HTR3ACNR1
SCHEMBL15509260 0.68 METAP2 (0.50) HSD11B1ALDH1A1
SCHEMBL24547678 0.68 ELANE (0.42) ALDH1A1
SCHEMBL24547763 0.68 TFPI2 (0.42) HSD11B1ALDH1A1
SCHEMBL24547680 0.67 ELANE (0.41) ALDH1A1CNR1

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 HSD11B1 313/4885SMO 4223/4885RORC 1601/4885

“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.