SCHEMBL3594645

SCHEMBL3594645

CC(C)(NC(=O)CBr)C(=O)OCN1C(=O)CCC(N2C(=O)c3ccccc3C2=O)C1=O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
DDB1 Q16531 7/20 0.35
CRBN Q96SW2 7/20 0.35
ALDH1A1 P00352 3/20 0.34
MAP1LC3B Q9GZQ8 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
CHRM2 P08172 1/20 0.34
OPRM1 P35372 1/20 0.34
IKZF3 Q9UKT9 1/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL3601478 0.89 MAP1LC3B (0.34) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B
SCHEMBL3599469 0.89 L3MBTL1 (0.35) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B
SCHEMBL3583970 0.89 L3MBTL1 (0.36) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B
Hydrochloric Acid SCHEMBL3593670 0.88 L3MBTL1 (0.34) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B
SCHEMBL3589942 0.88 KMT2A (0.37) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B
SCHEMBL24921832 0.85 DDB1 (0.40) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B
SCHEMBL3594808 0.84 CYP3A4 (0.36) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B
SCHEMBL3594804 0.84 CYP3A4 (0.36) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B
SCHEMBL3583758 0.83 CYP3A4 (0.42) DDB1CRBNALDH1A1MAP1LC3BTDP1
SCHEMBL3592415 0.83 L3MBTL1 (0.39) L3MBTL1DDB1CRBNALDH1A1MAP1LC3B

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-20100240651-A1 WATER-SOLUBLE THALIDOMIDE DERIVATIVES ZHANG HESHENG 2010-09-23 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-20100240651-A1 WATER-SOLUBLE THALIDOMIDE DERIVATIVES CCNH, CBR1, CBR3 L3MBTL1 1405/4885DDB1 2271/4885CRBN 5/4885

“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.