SCHEMBL17050844

SCHEMBL17050844

CCOCC(C=Cc1ccc(OC)c(C(F)(F)F)c1)(CCOC1CCCCO1)NC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.36
CREBBP Q92793 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
PTPN1 P18031 1/20 0.33
PDE4B Q07343 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
FDPS P14324 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.31

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
SCHEMBL17050384 0.89 KDM4E (0.37) APPCREBBPMEN1KMT2AALDH1A1
SCHEMBL17052075 0.86 APP (0.35) APPMEN1KMT2AALDH1A1MAPK1
SCHEMBL79148 0.77 HPGD (0.37) APPMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL79150 0.77 HPGD (0.37) APPMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL79149 0.77 HPGD (0.37) APPMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL30057466 0.67 FDPS (0.62) ALDH1A1PDE4BFDPSMAPT
SCHEMBL22369978 0.67 FDPS (0.62) ALDH1A1PDE4BFDPSMAPT
SCHEMBL19304004 0.66 KDM4E (0.54) APPMEN1KMT2AALDH1A1MAPK1
SCHEMBL29503029 0.65 NFE2L2 (0.62) APPCREBBPMEN1KMT2AALDH1A1
SCHEMBL26669477 0.65 NFE2L2 (0.62) APPCREBBPMEN1KMT2AALDH1A1

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-20150246938-A1 NOVEL OLEFIN DERIVATIVE SHIONOGI & CO., LTD. (JP) 2015-09-03 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-20150246938-A1 NOVEL OLEFIN DERIVATIVE ACSS2, ACACB, ACAT2 APP 2384/4885CREBBP 1324/4885MEN1 3985/4885

“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.