SCHEMBL10147575

SCHEMBL10147575

CCCCOc1ccc2c(c1)CCc1cc(O)ccc1/C(C)=C\2O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
NPC1 O15118 1/20 0.56
ALDH1A1 P00352 1/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MIF P14174 2/20 0.45
LTA4H P09960 2/20 0.44
NR5A1 Q13285 1/20 0.44
MAOB P27338 1/20 0.43
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
S1PR1 P21453 4/20 0.41
S1PR3 Q99500 2/20 0.41
ESR1 P03372 4/20 0.40
ESR2 Q92731 3/20 0.40
BRD4 O60885 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL722736 0.82 MEN1 (0.63) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL21300548 0.78 MAOB (0.64) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL20203126 0.77 MEN1 (0.52) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL8385525 0.77 MEN1 (0.59) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL12085703 0.76 MEN1 (0.52) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL15268088 0.75 MEN1 (0.54) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL18850173 0.73 ESR1 (0.52) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL22683261 0.73 MEN1 (0.46) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL339126 0.73 MEN1 (0.65) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL8272631 0.73 MAOB (0.69) MEN1NPC1ALDH1A1GAAMAPT

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-20120053299-A1 Cyclopropenones and the Photochemical Generation of Cyclic Alkynes Therefrom UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-03-01 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-20120053299-A1 Cyclopropenones and the Photochemical Generation of Cyclic Alkynes Therefrom WEE1, WEE2, MPI MEN1 3501/4885NPC1 4164/4885ALDH1A1 205/4885

“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.