SCHEMBL24873117

SCHEMBL24873117

CCOC(=O)C(=O)NCCOCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.56
▸ LMNA P02545 1/20 0.56
▸ HTT P42858 2/20 0.55
▸ ALDH1A1 P00352 1/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ GAA P10253 3/20 0.47
▸ MAPT P10636 1/20 0.46
▸ ASAH1 Q13510 1/20 0.45
▸ EGLN1 Q9GZT9 1/20 0.45
▸ NR1H4 Q96RI1 1/20 0.44
▸ HDAC3 O15379 1/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ HDAC9 Q9UKV0 1/20 0.44

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
SCHEMBL24873114 0.86 SMN1; SMN2 (0.54) SMN1; SMN2LMNAHTTALDH1A1L3MBTL1
SCHEMBL4109741 0.82 HDAC3 (0.62) SMN1; SMN2ALDH1A1GAAMAPTHDAC3
SCHEMBL7332230 0.82 SMN1; SMN2 (0.63) SMN1; SMN2LMNAHTTALDH1A1L3MBTL1
SCHEMBL4769824 0.81 SMN1; SMN2 (0.67) SMN1; SMN2LMNAHTTALDH1A1L3MBTL1
SCHEMBL21646851 0.81 SMN1; SMN2 (0.48) SMN1; SMN2LMNAHTTALDH1A1L3MBTL1
SCHEMBL13860786 0.81 SMN1; SMN2 (0.59) SMN1; SMN2LMNAALDH1A1L3MBTL1GAA
SCHEMBL7337026 0.79 SMN1; SMN2 (0.60) SMN1; SMN2LMNAHTTALDH1A1L3MBTL1
SCHEMBL15514552 0.79 HTT (0.55) SMN1; SMN2LMNAHTTALDH1A1L3MBTL1
SCHEMBL27805304 0.79 HTT (0.52) SMN1; SMN2LMNAHTTALDH1A1HDAC3
SCHEMBL8914641 0.79 SMN1; SMN2 (0.63) SMN1; SMN2LMNAHTTALDH1A1L3MBTL1

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-20230009608-A1 GRK2 INHIBITORS AND USES THEREOF SONATA THERAPEUTICS, INC. 2023-01-12 — — 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-20230009608-A1 GRK2 INHIBITORS AND USES THEREOF GRK2, GRK3, GRK1 SMN1; SMN2 2194/4885LMNA 3887/4885HTT 1888/4885

“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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