SCHEMBL7572218

SCHEMBL7572218

COC(=O)C=C1CCCC1C#N

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.35
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
SLC6A3 Q01959 3/20 0.31
MAPK10 P53779 1/20 0.30
THRB P10828 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL20400492 0.90 SLC6A2 (0.32) LMNASMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL19031049 0.80 CAMK2A (0.37) DPP4LMNASMN1; SMN2
SCHEMBL1812652 0.79 ESR2 (0.39) LMNASMN1; SMN2THRBALDH1A1MAPT
SCHEMBL1812651 0.79 ESR2 (0.39) LMNASMN1; SMN2THRBALDH1A1MAPT
SCHEMBL19031254 0.74 ALDH1A1 (0.36) LMNASMN1; SMN2ALDH1A1MAPTNPSR1
SCHEMBL9692780 0.71 SLC6A2 (0.31) LMNASLC6A2SLC6A4SLC6A3THRB
SCHEMBL22543476 0.68 ESR2 (0.31)
SCHEMBL8727375 0.67
SCHEMBL8727371 0.67
SCHEMBL16620652 0.67

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-6410486-B2 FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-06-25 US disclosed
US-20020019422-A1 Cycloalkylalkanecarboxamides and their preparation and use WETTERICH FRANK (DE) 2002-02-14 US disclosed
US-6265447-B1 FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-07-24 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-20020019422-A1 Cycloalkylalkanecarboxamides and their preparation and use CBR3, CYCS, CBR1 DPP4 4508/4885LMNA 1204/4885SMN1; SMN2 4443/4885

“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.