SCHEMBL6747879

SCHEMBL6747879

COc1cc(C=C(C#N)C(=O)NCCCN(C)C)cc(OC)c1O

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 10/20 0.76
▸ EGFR P00533 4/20 0.71
▸ KMT2A Q03164 6/20 0.66
▸ MEN1 O00255 4/20 0.66
▸ MAPT P10636 3/20 0.66
▸ ALDH1A1 P00352 4/20 0.59
▸ KDM4E B2RXH2 2/20 0.59
▸ NPC1 O15118 1/20 0.59
▸ POLB P06746 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ HPGD P15428 1/20 0.52
▸ MCL1 Q07820 1/20 0.52
▸ CTDSP1 Q9GZU7 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL8647197 0.88 ALDH1A1 (0.64) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL848237 0.86 DNM1 (1.00) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL848238 0.86 DNM1 (1.00) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL847685 0.78 DNM1 (0.78) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL847684 0.78 DNM1 (0.78) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL5461358 0.77 DNM1 (0.79) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL5461355 0.77 DNM1 (0.79) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL5461360 0.77 DNM1 (0.79) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL5597169 0.74 DNM1 (0.60) DNM1EGFRKMT2AMEN1MAPT
SCHEMBL4485755 0.74 DNM1 (0.60) DNM1EGFRKMT2AMEN1MAPT

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-6699463-B2 Photostable cationic organic sunscreen compounds with antioxidant properties and compositions obtained therefrom EM INDUSTRIES 2004-03-02 — — US disclosed
US-20030198607-A1 Photostable cationic organic sunscreen compounds with antioxidant properties and compositions obtained therefrom EM INDUSTRIES 2003-10-23 — — 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-20030198607-A1 Photostable cationic organic sunscreen compounds with antioxidant properties and compositions obtained therefrom DOHH, CYC1, TYR DNM1 4774/4885EGFR 804/4885KMT2A 3540/4885

“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.

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