SCHEMBL24154367

SCHEMBL24154367

c1cncc(OCC2CCCCN2)c1

nearest known ligand 0.92

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNA3 P32297 7/20 0.78
CHRNB4 P30926 4/20 0.78
CHRNB2 P17787 4/20 0.78
CHRNA4 P43681 4/20 0.78
CHRNA7 P36544 2/20 0.78
CHRNA1 P02708 1/20 0.78
CHRNG P07510 1/20 0.78
CHRNB1 P11230 1/20 0.78
CHRND Q07001 1/20 0.78
LTA4H P09960 6/20 0.62
CYP2D6 P10635 2/20 0.54
CYP3A4 P08684 1/20 0.54

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
SCHEMBL3942452 0.96 CHRNA3 (0.81) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
SCHEMBL905236 0.96 CHRNA3 (0.81) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
SCHEMBL905201 0.96 CHRNA3 (0.81) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
Hydrochloric Acid SCHEMBL7840031 0.94 CHRNA3 (0.78) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
Hydrochloric Acid SCHEMBL8439827 0.94 CHRNA3 (0.78) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
SCHEMBL401138 0.88 CHRNB2 (1.00) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
SCHEMBL29615733 0.88 CHRNB2 (1.00) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
SCHEMBL676026 0.88 CHRNB2 (1.00) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
SCHEMBL905208 0.88 CHRNB2 (1.00) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7
Hydrochloric Acid SCHEMBL7836790 0.87 CHRNB2 (0.97) CHRNA3CHRNB4CHRNB2CHRNA4CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230225323-A1 COMPOSITIONS AND METHODS FOR PARASITE CONTROL PHILIP MORRIS PRODUCTS S.A. (CH) 2023-07-20 US disclosed
US-20230225323-A1 COMPOSITIONS AND METHODS FOR PARASITE CONTROL PHILIP MORRIS PRODUCTS S.A. (CH) 2023-07-20 US disclosed
CN-115698002-A Compositions and methods for parasite control 菲利普莫里斯生产公司 2023-02-03 CN disclosed
WO-2021260029-A1 COMPOSITIONS AND METHODS FOR PARASITE CONTROL PHILIP MORRIS PRODUCTS S.A. (CH) 2021-12-30 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-20230225323-A1 COMPOSITIONS AND METHODS FOR PARASITE CONTROL TRHDE, CUTA, PIGS CHRNA3 3915/4885CHRNB4 4655/4885CHRNB2 4302/4885

“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.