SCHEMBL9916048

SCHEMBL9916048

CCC(C)(C)C(=O)OCC(=O)N1C(=O)C2C3CCC(C3)C21

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 3/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
RIPK1 Q13546 1/20 0.32
MAPT P10636 1/20 0.31
HMGCR P04035 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
SCHEMBL9916033 0.82 RIPK1 (0.43) SMN1; SMN2L3MBTL1KMT2AALDH1A1CYP2C19
SCHEMBL9916051 0.81
SCHEMBL9916041 0.80 HMGCR (0.31) HMGCR
SCHEMBL9916047 0.79 ALDH1A1 (0.37) SMN1; SMN2L3MBTL1KMT2AALDH1A1CYP3A4
SCHEMBL9915992 0.78 KMT2A (0.35) SMN1; SMN2L3MBTL1KMT2AALDH1A1CYP3A4
SCHEMBL9916046 0.73 HMGCR (0.37) KMT2AALDH1A1RIPK1HMGCR
SCHEMBL776629 0.73 HMGCR (0.34) KMT2AALDH1A1RIPK1HMGCR
SCHEMBL9916049 0.72 HMGCR (0.36) KMT2AALDH1A1RIPK1HMGCR
SCHEMBL9916034 0.72 HMGCR (0.36) KMT2AALDH1A1RIPK1HMGCR
SCHEMBL107824 0.72 L3MBTL1 (0.44) SMN1; SMN2L3MBTL1KMT2AALDH1A1CYP3A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859183-B2 N-acyl-β-lactam derivative, macromolecular compound, and photoresist composition KURARAY CO., LTD. (JP) 2014-10-14 US disclosed
US-8753794-B2 N-acyl-β-lactam derivative, macromolecular compound, and photoresist composition KURARAY CO., LTD. (JP) 2014-06-17 US disclosed
US-20140038106-A1 N-ACYL-B-LACTAM DERIVATIVE, MACROMOLECULAR COMPOUND, AND PHOTORESIST COMPOSITION KURARAY CO., LTD. (JP) 2014-02-06 US disclosed
US-20120148954-A1 N-ACYL-B-LACTAM DERIVATIVE, MACROMOLECULAR COMPOUND, AND PHOTORESIST COMPOSITION KURARAY CO., LTD. (JP) 2012-06-14 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-20120148954-A1 N-ACYL-B-LACTAM DERIVATIVE, MACROMOLECULAR COMPOUND, AND PHOTORESIST COMPOSITION COASY, ARCN1, CLTB SMN1; SMN2 4188/4885L3MBTL1 2296/4885KMT2A 1448/4885

“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.