SCHEMBL20176815

SCHEMBL20176815

CCOC(=O)/C(=C/c1ccc(C)o1)C(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.51
ALDH1A1 P00352 6/20 0.51
PKM P14618 3/20 0.51
POLB P06746 2/20 0.51
HTT P42858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GLO1 Q04760 3/20 0.50
CYP1A2 P05177 3/20 0.49
MEN1 O00255 9/20 0.47
KMT2A Q03164 9/20 0.47
LMNA P02545 5/20 0.47
NPSR1 Q6W5P4 4/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
GAA P10253 1/20 0.47
CYP2D6 P10635 1/20 0.47
GPR55 Q9Y2T6 1/20 0.47
KDM4E B2RXH2 3/20 0.46

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
SCHEMBL20163172 0.92 MEN1 (0.56) MAPTALDH1A1PKMPOLBHTT
SCHEMBL20176817 0.84 MAPT (0.54) MAPTALDH1A1PKMPOLBHTT
SCHEMBL8824441 0.84 CYP1A2 (0.51) MAPTALDH1A1PKMPOLBHTT
SCHEMBL8824439 0.84 CYP1A2 (0.51) MAPTALDH1A1PKMPOLBHTT
SCHEMBL20163177 0.84 ALDH1A1 (0.63) MAPTALDH1A1PKMPOLBHTT
SCHEMBL643933 0.79 CYP1A2 (0.50) MAPTALDH1A1PKMPOLBHTT
SCHEMBL643932 0.79 CYP1A2 (0.50) MAPTALDH1A1PKMPOLBHTT
SCHEMBL1720746 0.79 CYP1A2 (0.50) MAPTALDH1A1PKMPOLBHTT
SCHEMBL12544437 0.79 MAPT (0.46) MAPTALDH1A1PKMPOLBHTT
SCHEMBL1555421 0.79 MAPT (0.46) MAPTALDH1A1PKMPOLBHTT

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-20180140525-A1 AGENT FOR STABILIZING KERATIN FIBERS WITH 5-RING HETEROCYCLES HENKEL AG & CO. KGAA (DE) 2018-05-24 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-20180140525-A1 AGENT FOR STABILIZING KERATIN FIBERS WITH 5-RING HETEROCYCLES KRT18, NDUFS5, NDUFA5 MAPT 1624/4885ALDH1A1 992/4885PKM 2202/4885

“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.