SCHEMBL4388294

SCHEMBL4388294

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CNR1 P21554 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
CYP2C19 P33261 1/20 0.42
PDGFRA P16234 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR5 Q9H228 1/20 0.41
NR4A2 P43354 2/20 0.41
PRKCA P17252 1/20 0.41
PRKCD Q05655 1/20 0.41
IDO1 P14902 2/20 0.41
MAOB P27338 3/20 0.41
POLB P06746 2/20 0.40
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL4410979 0.88 MEN1 (0.48) MEN1KMT2ASMN1; SMN2CYP2C19PDGFRA
SCHEMBL4379562 0.86 MEN1 (0.48) MEN1KMT2ACNR1SMN1; SMN2CYP2C19
SCHEMBL4387904 0.85 MEN1 (0.47) MEN1KMT2ACNR1SMN1; SMN2CYP2C19
SCHEMBL4382696 0.85 KMT2A (0.53) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL4395353 0.85 MEN1 (0.45) MEN1KMT2ACNR1NR4A2PRKCA
SCHEMBL4380358 0.84 LMNA (0.51) MEN1KMT2ASMN1; SMN2CYP2C19NR4A2
SCHEMBL4382633 0.83 MEN1 (0.43) MEN1KMT2ACNR1NR4A2PRKCA
SCHEMBL8212151 0.83 KMT2A (0.45) MEN1KMT2AMAOBPOLBMAPT
SCHEMBL8221599 0.83 KMT2A (0.45) MEN1KMT2APDGFRAS1PR1S1PR5
SCHEMBL4382642 0.83 TACR1 (0.48) MEN1KMT2ASMN1; SMN2NR4A2PRKCA

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-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 MEN1 3694/4885KMT2A 2079/4885CNR1 38/4885

“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.