SCHEMBL25818354

SCHEMBL25818354

CN1OCC[C@H]1c1cnccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.32
SLC6A4 P31645 1/20 0.32
ALDH1A1 P00352 2/20 0.30
CHRNA7 P36544 2/20 0.30
CHRNB2 P17787 2/20 0.30
CHRNB4 P30926 2/20 0.30
CHRNA3 P32297 2/20 0.30
CHRNA4 P43681 2/20 0.30
CHRNA2 Q15822 2/20 0.30
LMNA P02545 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
HTR3E A5X5Y0 1/20 0.30
PSIP1 O75475 1/20 0.30
TRPA1 O75762 1/20 0.30
HTR3B O95264 1/20 0.30
CHRNA1 P02708 1/20 0.30
CHRNG P07510 1/20 0.30
MAPT P10636 1/20 0.30
CHRNB1 P11230 1/20 0.30
CYP2A6 P11509 1/20 0.30

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
SCHEMBL30581159 0.76 HRH3 (0.30) HRH3
SCHEMBL22772523 0.75 KDM4E (0.35) HRH3SLC6A4KDM4E
SCHEMBL25259697 0.75 KDM4E (0.35) ALDH1A1MAPTKDM4E
SCHEMBL30547544 0.71 GPR119 (0.46) KDM4E
SCHEMBL25816509 0.71 GPR119 (0.46) KDM4E
SCHEMBL12090453 0.70 CHRNB2 (0.56) ALDH1A1CHRNA7CHRNB2CHRNB4CHRNA3
SCHEMBL31200029 0.70 KLKB1 (0.33) ALDH1A1
SCHEMBL25816648 0.69 DYRK1A (0.39) HRH3KDM4E
SCHEMBL31196458 0.68 RIPK1 (0.35) KDM4E
SCHEMBL6232040 0.67 KDM4E (0.38) ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF SANOFI (FR) 2023-07-13 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-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF RIPK1, RIPK4, RIPK2 HRH3 985/4885SLC6A4 4772/4885ALDH1A1 2211/4885

“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.