SCHEMBL29707610

SCHEMBL29707610

CC(=O)Oc1cc2c(cc1C(C)C)[C@@H](O)[C@H](OC(C)=O)[C@H]1C(C)(C)CCC[C@]21C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ SOD1 P00441 1/20 0.35
▸ FDPS P14324 10/20 0.34
▸ GGPS1 O95749 5/20 0.34
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ CYP19A1 P11511 5/20 0.31
▸ PTGES O14684 1/20 0.31
▸ PNLIP P16233 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL18290303 0.87 SOD1 (0.38) CYP3A4TP53SOD1
SCHEMBL16499400 0.63 ALOX15 (0.34) ALOX15
SCHEMBL12821787 0.63 ALOX15 (0.34) ALOX15
Ugandensolide SCHEMBL21025899 0.63 MAPK1 (0.31) CYP3A4CYP19A1KMT2A
SCHEMBL12194936 0.62 KARS1 (0.52) CYP3A4TP53FDPSGGPS1ALDH1A1
SCHEMBL18290200 0.61 SOD1 (0.76) CYP3A4TP53SOD1FDPSGGPS1
SCHEMBL18290240 0.60 FDPS (0.48) CYP3A4TP53FDPSGGPS1ALDH1A1
SCHEMBL18290302 0.59 SOD1 (0.47) SOD1FDPSCYP19A1PTGESPNLIP
SCHEMBL3462790 0.58 CYP3A4 (1.00) CYP3A4TP53MAPTALOX15CYP19A1
SCHEMBL5527006 0.58 CYP3A4 (1.00) CYP3A4TP53MAPTALOX15CYP19A1

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-20220296683-A1 ORAL DELIVERY SYSTEM UNIVERSITY COLLEGE DUBLIN (IE) 2022-09-22 — — US disclosed
EP-4021408-A1 ORAL DELIVERY SYSTEM University College Dublin (IE) 2022-07-06 — — EP 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-20220296683-A1 ORAL DELIVERY SYSTEM GLP1R, GIPR, IAPP CYP3A4 3459/4885TP53 2750/4885SOD1 1661/4885

“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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