SCHEMBL3592613

SCHEMBL3592613

O=C(CN(CCO)CCO)OCN1C(=O)CCC(N2C(=O)c3ccccc3C2=O)C1=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 7/20 0.39
CRBN Q96SW2 7/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
CYP1A2 P05177 2/20 0.39
CHRM2 P08172 1/20 0.39
OPRM1 P35372 1/20 0.39
IKZF3 Q9UKT9 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAP1LC3B Q9GZQ8 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 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
SCHEMBL2910295 0.89 L3MBTL1 (0.40) DDB1CRBNALDH1A1TDP1CYP1A2
Hydrochloric Acid SCHEMBL2919200 0.88 L3MBTL1 (0.39) DDB1CRBNALDH1A1TDP1CYP1A2
SCHEMBL13167679 0.86 L3MBTL1 (0.41) DDB1CRBNALDH1A1TDP1CYP1A2
Hydrochloric Acid SCHEMBL2910258 0.85 L3MBTL1 (0.41) DDB1CRBNALDH1A1TDP1CYP1A2
SCHEMBL2918755 0.85 ALDH1A1 (0.41) DDB1CRBNALDH1A1TDP1CYP1A2
SCHEMBL3592001 0.83 ALDH1A1 (0.41) DDB1CRBNALDH1A1TDP1CYP1A2
Hydrochloric Acid SCHEMBL7740778 0.82 ALDH1A1 (0.40) DDB1CRBNALDH1A1TDP1CYP1A2
SCHEMBL5478671 0.81 ALDH1A1 (0.43) DDB1CRBNALDH1A1TDP1CYP1A2
SCHEMBL4938342 0.81 ALDH1A1 (0.42) DDB1CRBNALDH1A1TDP1CYP1A2
SCHEMBL13297907 0.80 DDB1 (0.43) DDB1CRBNALDH1A1TDP1CYP1A2

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-20100240651-A1 WATER-SOLUBLE THALIDOMIDE DERIVATIVES ZHANG HESHENG 2010-09-23 US claimed
US-20100240651-A1 WATER-SOLUBLE THALIDOMIDE DERIVATIVES ZHANG HESHENG 2010-09-23 US disclosed
US-20100240651-A1 WATER-SOLUBLE THALIDOMIDE DERIVATIVES ZHANG HESHENG 2010-09-23 US disclosed
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 DDB1 2271/4885CRBN 5/4885ALDH1A1 2635/4885

“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.