SCHEMBL29329864

SCHEMBL29329864

CC(C)NC(=O)Oc1ccc2c(c1)COc1cc(OC(=O)NC(C)C)ccc1-2

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 3/20 0.46
ROCK2 O75116 4/20 0.45
PIK3CA P42336 5/20 0.43
PIK3CD O00329 3/20 0.43
PIK3CG P48736 3/20 0.43
PIK3CB P42338 2/20 0.43
AAK1 Q2M2I8 4/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MMP2 P08253 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL29329861 0.82 ACHE (0.49) ALDH1A1SMN1; SMN2MAPTROCK2ACHE
SCHEMBL802630 0.76 MAPT (0.48) ALDH1A1SMN1; SMN2MAPTROCK2PIK3CA
SCHEMBL29853545 0.76 MAPT (0.71) ALDH1A1SMN1; SMN2MAPTROCK2PIK3CA
SCHEMBL3196920 0.73 MAPT (0.56) ALDH1A1SMN1; SMN2MAPTROCK2AAK1
SCHEMBL15292004 0.70 MAPT (0.44) ALDH1A1SMN1; SMN2MAPTROCK2PIK3CA
SCHEMBL31665889 0.69 PIK3CA (0.69) PIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL4483341 0.68 MAPT (0.66) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL2729559 0.68 MAPT (0.64) ALDH1A1SMN1; SMN2MAPTKMT2AHSD17B10
SCHEMBL3888082 0.68 ACHE (0.50) ACHE
SCHEMBL27762355 0.68 MAPT (0.50) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A

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-20240239762-A1 NOVEL HETEROCYCLIC COMPOUNDS FLORATEK PHARMA S A (CH) 2024-07-18 US disclosed
US-20240239762-A1 NOVEL HETEROCYCLIC COMPOUNDS FLORATEK PHARMA S A (CH) 2024-07-18 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-20240239762-A1 NOVEL HETEROCYCLIC COMPOUNDS UGT1A1, SLC10A1, CYP11B1 ALDH1A1 137/4885SMN1; SMN2 664/4885MAPT 1308/4885

“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.