SCHEMBL4395320

SCHEMBL4395320

O=C(Nc1ccccc1)C(=O)N1CCC(=NOCc2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.53
FAAH O00519 2/20 0.51
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 3/20 0.48
HTT P42858 3/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 3/20 0.44
MRGPRX4 Q96LA9 1/20 0.43
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
UBE2M P61081 1/20 0.41
DCUN1D1 Q96GG9 1/20 0.41

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
SCHEMBL4395452 0.90 FAAH (0.63) FAAHMEN1KMT2AMAPTHTT
SCHEMBL4393140 0.85 NR4A2 (0.46) FAAHMEN1KMT2AMAPTLMNA
SCHEMBL4410979 0.85 MEN1 (0.48) FAAHMEN1KMT2AMAPTLMNA
SCHEMBL4380358 0.83 LMNA (0.51) MEN1KMT2AMAPTLMNAMRGPRX4
SCHEMBL4552460 0.82 FAAH (0.53) FAAHMEN1KMT2AMAPTHTT
SCHEMBL4388294 0.80 MEN1 (0.51) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL13588940 0.79 DPP4 (0.46) FAAHMEN1KMT2AMAPTLMNA
SCHEMBL4387904 0.78 MEN1 (0.47) FAAHMEN1KMT2AMAPTLMNA
SCHEMBL4382642 0.78 TACR1 (0.48) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL4379562 0.77 MEN1 (0.48) RAB9AMEN1KMT2AMAPTHTT

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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 RAB9A 4109/4885FAAH 1521/4885MEN1 3694/4885

“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.