SCHEMBL4887895

SCHEMBL4887895

CC(C)(C)C[SiH2]OCC(CO)CN1CCN(c2ccc(OC(F)(F)F)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.40
HSP90AB1 P08238 1/20 0.40
MAPT P10636 4/20 0.39
CACNA1G O43497 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
TP53 P04637 1/20 0.37
KCNH2 Q12809 1/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
KCNA5 P22460 1/20 0.36
ABCB1 P08183 1/20 0.36

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
SCHEMBL4776051 0.83 CACNA1G (0.46) CHRM4HSP90AB1MAPTCACNA1GALDH1A1
SCHEMBL4778842 0.80 HSP90AB1 (0.40) CHRM4HSP90AB1MAPTCACNA1GKDM4E
SCHEMBL19095368 0.77 MAPT (0.47) CHRM4HSP90AB1MAPTCACNA1GALDH1A1
SCHEMBL17432438 0.70 PPARD (0.49) CHRM4MAPTCACNA1GKDM4EALDH1A1
SCHEMBL19538665 0.69 TSHR (0.68) CHRM4MAPTKDM4EALDH1A1KMT2A
SCHEMBL19095372 0.69 ALDH1A1 (0.43) CHRM4HSP90AB1MAPTCACNA1GKDM4E
SCHEMBL5536931 0.68 KCNA5 (0.53) CHRM4MAPTKDM4EALDH1A1KMT2A
SCHEMBL22963896 0.67 HRH3 (0.58) CHRM4PPARDPPARAKCNA5
SCHEMBL5534678 0.67 KMT2A (0.52) CHRM4ALDH1A1MEN1KMT2APPARD
SCHEMBL5534516 0.66 ALDH1A1 (0.62) CHRM4MAPTALDH1A1PPARDPPARA

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-20080275035-A1 Nitroimidazole Compounds JIRICEK JAN 2008-11-06 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-20080275035-A1 Nitroimidazole Compounds NQO2, NQO1, MT-ND2 CHRM4 2666/4885HSP90AB1 772/4885MAPT 2122/4885

“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.