SCHEMBL9915993

SCHEMBL9915993

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

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 4/20 0.32
HPGD P15428 1/20 0.32
CYP1A2 P05177 2/20 0.30
CYP2C19 P33261 2/20 0.30
GAA P10253 2/20 0.30
L3MBTL1 Q9Y468 2/20 0.30
MEN1 O00255 2/20 0.30
DPP4 P27487 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL9916047 0.77 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2KMT2ACYP1A2CYP2C19
SCHEMBL9915939 0.77 KMT2A (0.36) ALDH1A1SMN1; SMN2KMT2AHPGDCYP1A2
SCHEMBL9915992 0.76 KMT2A (0.35) ALDH1A1SMN1; SMN2KMT2ACYP2C19L3MBTL1
SCHEMBL9915981 0.74 KMT2A (0.32) SMN1; SMN2KMT2A
SCHEMBL9915986 0.74 KMT2A (0.32) KMT2A
SCHEMBL15800068 0.69 CYP3A4 (0.31) KMT2ACYP2C19MEN1CYP3A4
SCHEMBL9916993 0.68 L3MBTL1 (0.31) ALDH1A1SMN1; SMN2KMT2ACYP1A2CYP2C19
SCHEMBL24595901 0.68 KMT2A (0.41) ALDH1A1SMN1; SMN2KMT2AHPGDCYP1A2
SCHEMBL9916016 0.68 MAPT (0.32) KMT2A
SCHEMBL12098030 0.61 SMN1; SMN2 (0.36) ALDH1A1SMN1; SMN2KMT2AHPGDKDM4E

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 7 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-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-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-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 ALDH1A1 3234/4885SMN1; SMN2 4188/4885KMT2A 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.