SCHEMBL14294652

SCHEMBL14294652

CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)OCCN1C(=O)CCC(N2C(=O)c3ccccc3C2=O)C1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 2/20 0.42
CRBN Q96SW2 2/20 0.42
MAP1LC3B Q9GZQ8 1/20 0.39
KMT2A Q03164 3/20 0.38
KLK5 Q9Y337 1/20 0.38
TLR2 O60603 1/20 0.38
TLR1 Q15399 1/20 0.38
SCN9A Q15858 7/20 0.37
MEN1 O00255 2/20 0.37
ATM Q13315 1/20 0.37
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RAB9A P51151 1/20 0.35
APP P05067 1/20 0.35
CCKAR P32238 1/20 0.35
CCKBR P32239 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
SCHEMBL14142265 1.00 DDB1 (0.42) DDB1CRBNMAP1LC3BKMT2AKLK5
SCHEMBL7742010 0.91 DDB1 (0.43) DDB1CRBNKMT2AKLK5TLR2
SCHEMBL14142266 0.87 KMT2A (0.43) DDB1CRBNKMT2ASCN9AMEN1
SCHEMBL14294650 0.86 SCN9A (0.49) KMT2ASCN9ACCKARCCKBR
SCHEMBL14294653 0.86 MAP1LC3B (0.39) DDB1CRBNMAP1LC3BKMT2A
SCHEMBL14142180 0.86 MAP1LC3B (0.39) DDB1CRBNMAP1LC3BKMT2A
SCHEMBL14141937 0.83 MAP1LC3B (0.36) DDB1CRBNMAP1LC3BKMT2ACYP3A4
SCHEMBL14294711 0.83 MAP1LC3B (0.36) DDB1CRBNMAP1LC3BKMT2ACYP3A4
SCHEMBL22143891 0.83 DDB1 (0.45) DDB1CRBNKMT2AMEN1CYP3A4
Hydrochloric Acid SCHEMBL14142396 0.82 MAP1LC3B (0.36) DDB1CRBNMAP1LC3BKMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8637545-B2 Piperidine-2, 6-dione derivatives and their use as tumor necrosis factor inhibitors TIANJIN HEMAY BIO-TECH CO., LTD. (CN) 2014-01-28 US disclosed
US-20080051432-A1 PIPERIDINE-2, 6-DIONE DERIVATIVES AND THEIR USE AS TUMOR NECROSIS FACTOR INHIBITORS TIANJIN HEMAY PHARMACEUTICAL CO., LTD. (CN) 2008-02-28 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-20080051432-A1 PIPERIDINE-2, 6-DIONE DERIVATIVES AND THEIR USE AS TUMOR NECROSIS FACTOR INHIBITORS TNF, TNFRSF1A, TNFRSF9 DDB1 2336/4885CRBN 896/4885MAP1LC3B 4651/4885

“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.