SCHEMBL5141306

SCHEMBL5141306

C=CC(=O)C=C(c1c(F)cccc1F)c1c(F)cccc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.48
CES1 P23141 4/20 0.48
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 1/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
BCHE P06276 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
HTT P42858 1/20 0.35
NOD2 Q9HC29 1/20 0.35
GAA P10253 2/20 0.35
MGAM O43451 1/20 0.35
AMY1A P0DUB6 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
ALB P02768 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL4140545 0.75 CES2 (0.56) CES2CES1TDP1LMNAKMT2A
SCHEMBL7537673 0.70 CES2 (0.55) CES2CES1NPC1RAB9A
SCHEMBL16502 0.69 AKT1 (0.56) CES2CES1TDP1LMNAKMT2A
SCHEMBL28042991 0.69 CES2 (0.48) CES2CES1TDP1LMNAKMT2A
Propene SCHEMBL27785695 0.68 CES2 (0.52) CES2CES1TDP1LMNAKMT2A
SCHEMBL2095659 0.68 CES2 (0.64) CES2CES1TDP1LMNAKMT2A
SCHEMBL669455 0.67 CA12 (0.50) LMNAKMT2AMEN1GAANPC1
SCHEMBL2834918 0.67 CES2 (0.50) CES2CES1TDP1LMNAKMT2A
SCHEMBL3661967 0.67 KDM4E (0.48) TDP1LMNAKMT2AMEN1BCHE
SCHEMBL15200630 0.67 KMT2A (0.50) CES2CES1TDP1LMNAKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371766-B2 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY (US) 2008-05-13 US disclosed
US-20040176384-A1 Curcumin analogs with anti-tumor and anti-angiogenic properties EMORY UNIVERSITY 2004-09-09 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-20040176384-A1 Curcumin analogs with anti-tumor and anti-angiogenic properties PGF, VEGFA, VHL CES2 4723/4885CES1 3091/4885TDP1 4827/4885

“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.