SCHEMBL26564933

SCHEMBL26564933

CCC(=O)Cc1ccccc1CC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
IAPP P10997 2/20 0.41
HSD11B1 P28845 1/20 0.40
AKR1B1 P15121 1/20 0.38
CYP3A4 P08684 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
ALDH1A1 P00352 4/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL21100152 0.91 IAPP (0.46) L3MBTL1IAPPHSD11B1AKR1B1GABRA1
SCHEMBL29210932 0.87 GABRA1 (0.44) IAPPHSD11B1AKR1B1GABRA1GABRB2
SCHEMBL6805430 0.87 L3MBTL1 (0.57) L3MBTL1IAPPAKR1B1CYP3A4GABRA1
SCHEMBL7150622 0.85 L3MBTL1 (0.52) L3MBTL1IAPPAKR1B1CYP3A4GABRA1
Benzene SCHEMBL10992898 0.84 L3MBTL1 (0.60) L3MBTL1IAPPAKR1B1CYP3A4ALDH1A1
SCHEMBL30610413 0.79 AKR1B1 (0.63) IAPPAKR1B1GABRA1GABRB2
SCHEMBL363774 0.79 CTBP2 (0.53) ALDH1A1MAPTGAASMN1; SMN2NPC1
SCHEMBL156141 0.79 AKR1B1 (0.63) IAPPAKR1B1GABRA1GABRB2
SCHEMBL8915286 0.79 SLC6A2 (0.41) IAPPHSD11B1ALDH1A1LMNA
SCHEMBL8083911 0.79 GABRA1 (0.47) IAPPHSD11B1AKR1B1GABRA1GABRB2

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-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES Atea Pharmaceuticals, Inc. (US) 2023-10-19 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-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES NUDT1, PNP, ATIC L3MBTL1 3712/4885IAPP 2154/4885HSD11B1 2381/4885

“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.