SCHEMBL9916030

SCHEMBL9916030

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

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CYP2C19 P33261 3/20 0.37
CYP1A2 P05177 2/20 0.37
ALDH1A1 P00352 5/20 0.36
HPGD P15428 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
GAA P10253 3/20 0.34
ACE P12821 2/20 0.34
DPP4 P27487 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
EPHX2 P34913 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL9916044 0.77 ACE (0.31) ACEEPHX2
SCHEMBL9916032 0.76 EPHX2 (0.34) SMN1; SMN2KMT2AMEN1ACEEPHX2
SCHEMBL9916047 0.76 ALDH1A1 (0.37) SMN1; SMN2CYP2C19CYP1A2ALDH1A1KMT2A
SCHEMBL9916033 0.75 RIPK1 (0.43) SMN1; SMN2CYP2C19CYP1A2ALDH1A1KMT2A
SCHEMBL9915993 0.73 ALDH1A1 (0.39) SMN1; SMN2CYP2C19CYP1A2ALDH1A1HPGD
SCHEMBL9916993 0.71 L3MBTL1 (0.31) SMN1; SMN2CYP2C19CYP1A2ALDH1A1KMT2A
SCHEMBL9915939 0.71 KMT2A (0.36) SMN1; SMN2CYP2C19CYP1A2ALDH1A1HPGD
SCHEMBL9916029 0.69 EPHX2 (0.42) SMN1; SMN2ACEEPHX2
SCHEMBL9916027 0.69 EPHX2 (0.46) SMN1; SMN2CYP2C19ALDH1A1KMT2AACE
SCHEMBL9915938 0.69 KMT2A (0.37) SMN1; SMN2CYP2C19CYP1A2ALDH1A1KMT2A

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 4188/4885CYP2C19 1199/4885CYP1A2 1235/4885

“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.