SCHEMBL24120100

SCHEMBL24120100

CCS(=O)(=O)N1CC2(CC(=O)C(c3c(C)cc(-c4ccc(F)cc4)cc3OC)C(=O)C2)C1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MCHR1 Q99705 4/20 0.33
HTR2C P28335 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
PIK3CA P42336 2/20 0.33
CCR5 P51681 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.33
TNF P01375 1/20 0.33
NOD1 Q9Y239 1/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
CNR1 P21554 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
SCHEMBL24120471 0.92 MCHR1 (0.34) MCHR1LMNAHDAC1HDAC2
SCHEMBL21361264 0.90 SLC6A9 (0.35) SMN1; SMN2MCHR1KDM4EMAPTTSHR
SCHEMBL24120348 0.87 KDM1A (0.35) PDE4BMAPTMEN1KMT2A
SCHEMBL24120144 0.85 SCN9A (0.32)
SCHEMBL24120328 0.83 HDAC2 (0.41) PDE4BHTR2CMAPTHDAC1HDAC2
SCHEMBL24120405 0.83 HDAC1 (0.44) PDE4BMAPTMEN1KMT2AHDAC1
SCHEMBL24120346 0.82 APOL1 (0.41) PIK3CAHDAC1HDAC2CNR1CNR2
SCHEMBL24120334 0.82 CYP2C19 (0.37) PDE4BSMN1; SMN2TSHRMEN1ALDH1A1
SCHEMBL21361312 0.81 PTGS2 (0.35) MCHR1
SCHEMBL24120445 0.81 ALDH1A1 (0.40) PDE4BSMN1; SMN2KDM4EMAPTMEN1

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-20210395196-A1 HERBICIDAL 2-AZASPIRO[3-5]NONANE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-12-23 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-20210395196-A1 HERBICIDAL 2-AZASPIRO[3-5]NONANE COMPOUNDS DDT, AZI2, CBR3 PDE4B 454/4885SMN1; SMN2 4409/4885MCHR1 847/4885

“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.