SCHEMBL25812286

SCHEMBL25812286

Clc1cnc(N2CC3CC(C3)C2)cn1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM2 P08172 1/20 0.37
CNR2 P34972 1/20 0.36
PANK3 Q9H999 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
GRM1 Q13255 2/20 0.35
OGA O60502 1/20 0.35
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
CHRNA7 P36544 1/20 0.32

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
SCHEMBL22795652 0.84 CHRNB4 (0.38) SMPD3CHRM4CHRM2PANK3CHRNB4
SCHEMBL12524364 0.82 CHRM4 (0.39) CHRM4CHRM2CNR2PANK3CHRNB4
SCHEMBL20071399 0.81 CHRNB4 (0.57) CHRNB4CHRNA3CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL23607806 0.79 CHRNB4 (0.56) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL22795641 0.79 SMPD3 (0.39) SMPD3CHRM4CHRM2PANK3CHRNB4
Hydrochloric Acid SCHEMBL29566662 0.79 CHRNB4 (0.56) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL23744768 0.78 CHRNB4 (0.39) CHRM4CHRM2CNR2PANK3CHRNB4
SCHEMBL22795905 0.78 CNR2 (0.39) CHRM4CHRM2CNR2PANK3CHRNB4
SCHEMBL23744094 0.78 CHRNB4 (0.39) CHRM4CHRM2CNR2PANK3CHRNB4
SCHEMBL24624329 0.78 CHRM4 (0.37) CHRM4CHRM2CNR2PANK3CHRNB4

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-20230219979-A1 PYRAZOLO[1,5-a]PYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SHENZHEN ZHONGGE BIOLOGICAL TECHNOLOGY CO., LTD. (CN) 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-20230219979-A1 PYRAZOLO[1,5-a]PYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF RET, GRK4, RIN1 SMPD3 4338/4885CHRM4 2891/4885CHRM2 4161/4885

“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.