SCHEMBL6490833

SCHEMBL6490833

COC(=O)C=C1C/C=C\C[C]Cc2ccccc2C1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.31
RAB9A P51151 1/20 0.30
MAPT P10636 2/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL6490830 0.79 RAB9A (0.32) ALDH1A1RAB9AMAPTMEN1LMNA
SCHEMBL27324699 0.79 ALDH1A1 (0.40) ALDH1A1RAB9AMAPTMEN1LMNA
SCHEMBL6479332 0.70 CYP1A2 (0.48)
SCHEMBL6482738 0.67 CYP1A2 (0.30)
Acrylic Acid Methyl Ester SCHEMBL27679174 0.63 ALOX15 (0.39) ALDH1A1RAB9AMAPTHTT
SCHEMBL5473940 0.62 ESR2 (0.48) ALDH1A1MAPTMEN1LMNAHPGD
SCHEMBL6480327 0.60 FABP7 (0.35) KMT2A
SCHEMBL12666796 0.59 ALDH1A1 (0.35) ALDH1A1MAPTMEN1LMNAKMT2A
SCHEMBL518574 0.59
SCHEMBL23087148 0.59 HCAR2 (0.46) ALDH1A1MAPTMEN1LMNAHPGD

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-20050288238-A1 Benzocyclodecane derivatives with antitumor activity PFIZER INC 2005-12-29 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-20050288238-A1 Benzocyclodecane derivatives with antitumor activity H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, OR10J3, BCL6 ALDH1A1 1416/4885RAB9A 172/4885MAPT 4686/4885

“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.