SCHEMBL17077380

SCHEMBL17077380

COc1cc(/C=C2\CCC/C(=C\c3ccc(OC)c(O)c3)C2=O)cc(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 1.00
NFE2L2 Q16236 1/20 0.70
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
JUN P05412 1/20 0.68
MME P08473 1/20 0.68
NFKB1 P19838 1/20 0.68
NOD2 Q9HC29 1/20 0.68
XDH P47989 4/20 0.65
ALOX5 P09917 1/20 0.60
NQO1 P15559 1/20 0.60
NQO2 P16083 1/20 0.60
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2C9 P11712 1/20 0.60
KDM4E B2RXH2 1/20 0.60
POLB P06746 1/20 0.60
MAPT P10636 1/20 0.60
THRB P10828 1/20 0.60
MAPK1 P28482 1/20 0.60

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
SCHEMBL17077382 1.00 EGFR (1.00) EGFRNFE2L2MEN1KMT2AJUN
SCHEMBL17077384 0.95 EGFR (0.90) EGFRNFE2L2MEN1KMT2AJUN
SCHEMBL17077386 0.95 EGFR (0.90) EGFRNFE2L2MEN1KMT2AJUN
SCHEMBL17077399 0.90 EGFR (1.00) EGFRNFE2L2MEN1KMT2AJUN
SCHEMBL17077396 0.90 EGFR (1.00) EGFRNFE2L2MEN1KMT2AJUN
SCHEMBL17077347 0.84 EGFR (1.00) EGFRNFE2L2XDHCYP1A2CYP2C9
SCHEMBL17077345 0.84 EGFR (1.00) EGFRNFE2L2XDHCYP1A2CYP2C9
SCHEMBL17077357 0.84 EGFR (0.90) EGFRNFE2L2MEN1KMT2AJUN
SCHEMBL17077360 0.84 EGFR (0.90) EGFRNFE2L2MEN1KMT2AJUN
SCHEMBL1524276 0.84 EGFR (0.72) EGFRMEN1KMT2AJUNMME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9409845-B2 Alpha-(3,5-dimethoxybenzylidene)-alpha′-hydrocarbyl methylene cyclic ketone and preparation method thereof PHARMAXYN LABORATORIES LTD. (CN) 2016-08-09 US disclosed
EP-2927208-A1 A-(3,5-DIMETHOXY BENZYLIDENE)-A'-HYDROCARBYL METHYLENE CYCLIC KETONE AND PREPARATION METHOD THEREOF Pharmaxyn Laboratories Ltd. (CN) 2015-10-07 EP disclosed
US-20150259271-A1 alpha-(3,5-dimethoxybenzylidene)-alpha'-hydrocarbyl methylene cyclic ketone and preparation method thereof PHARMAXYN LABORATORIES LTD. (CN) 2015-09-17 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-20150259271-A1 alpha-(3,5-dimethoxybenzylidene)-alpha'-hydrocarbyl methylene cyclic ketone and preparation method thereof EGFR, KDR, BMI1 EGFR 1/4885NFE2L2 50/4885MEN1 1167/4885

“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.