SCHEMBL5143776

SCHEMBL5143776

CC(C)(C)OC(=O)C1CCC=CN1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.34
HRH3 Q9Y5N1 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
PREP P48147 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
SCHEMBL3664438 0.82 MAPK1 (0.36) MAPK1HRH3CHRM2CHRM1CHRM3
SCHEMBL3642481 0.80 MAPT (0.34) CHRM2CHRM3
Hydrochloric Acid SCHEMBL8733450 0.79 MAPT (0.33) CHRM2CHRM3
SCHEMBL6588171 0.78 MAPK1 (0.33) MAPK1HRH3
SCHEMBL3665014 0.76 ALDH1A1 (0.43) MAPK1
Hydrochloric Acid SCHEMBL8731964 0.75 ALDH1A1 (0.42) MAPK1
SCHEMBL931733 0.74
SCHEMBL325433 0.71
SCHEMBL15330716 0.71
SCHEMBL25684409 0.71 MAPK1 (0.37) MAPK1HRH3CHRM2CHRM1CHRM3

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
CN-114126620-A FGFR inhibitors and methods of use thereof 传达治疗有限公司 2022-03-01 CN disclosed
CN-103237800-B Amide derivatives and use thereof MITSUBISHI TANABE PHARMA CORP. (JP) 2015-10-21 CN disclosed
US-20070191416-A1 Tetrahydropyridoindole derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2007-08-16 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-20070191416-A1 Tetrahydropyridoindole derivatives TPH2, TPH1, HTR2C MAPK1 3651/4885HRH3 290/4885CHRM2 647/4885

“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.