SCHEMBL2910295

SCHEMBL2910295

CCN(CC)CC(=O)OCN1C(=O)CCC(N2C(=O)c3ccccc3C2=O)C1=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
DDB1 Q16531 6/20 0.39
CRBN Q96SW2 6/20 0.39
ALDH1A1 P00352 5/20 0.39
HPGD P15428 1/20 0.38
CYP1A2 P05177 2/20 0.38
CHRM2 P08172 1/20 0.38
OPRM1 P35372 1/20 0.38
IKZF3 Q9UKT9 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAP1LC3B Q9GZQ8 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
Hydrochloric Acid SCHEMBL2919200 0.99 L3MBTL1 (0.39) L3MBTL1DDB1CRBNALDH1A1HPGD
SCHEMBL4938342 0.90 ALDH1A1 (0.42) L3MBTL1DDB1CRBNALDH1A1CYP1A2
SCHEMBL3593651 0.90 ALDH1A1 (0.41) L3MBTL1DDB1CRBNALDH1A1HPGD
SCHEMBL13167679 0.89 L3MBTL1 (0.41) L3MBTL1DDB1CRBNALDH1A1HPGD
Hydrochloric Acid SCHEMBL4931975 0.89 ALDH1A1 (0.41) L3MBTL1DDB1CRBNALDH1A1CYP1A2
SCHEMBL3592613 0.89 DDB1 (0.39) L3MBTL1DDB1CRBNALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL2910258 0.88 L3MBTL1 (0.41) L3MBTL1DDB1CRBNALDH1A1HPGD
SCHEMBL4937675 0.87 NPSR1 (0.43) L3MBTL1DDB1CRBNALDH1A1HPGD
SCHEMBL5478671 0.86 ALDH1A1 (0.43) L3MBTL1DDB1CRBNALDH1A1HPGD
SCHEMBL2918755 0.86 ALDH1A1 (0.41) L3MBTL1DDB1CRBNALDH1A1HPGD

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-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
EP-1607394-B1 WATER-SOLUBLE THALIDOMINE DERIVATIVES TIAN JIN HEMAY BIO TECH CO LTD (CN) 2010-09-01 EP disclosed
US-7741342-B2 Water-soluble thalidomine derivatives Zhang, Hesheng (CN) 2010-06-22 US disclosed
US-20060094730-A1 having increased bioavailability when administered orally or by injection; used for treating erythema, behcet's syndrome, crohn's disease, rheumatoid arthritis, abnormal myeloidosis syndrome and tumors ZHANG, HESHENG (CN) 2006-05-04 US disclosed
EP-1607394-A1 WATER-SOLUBLE THALIDOMINE DERIVATIVES Tian Jin Hemay Bio-Tech Co., Ltd. (DE) 2005-12-21 EP 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 (2 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
US-20060094730-A1 having increased bioavailability when administered orally or by injection; used for treating erythema, behcet's syndrome, crohn's disease, rheumatoid arthritis, abnormal myeloidosis syndrome and tumors FCGRT, MALT1, IL1R1 L3MBTL1 3605/4885DDB1 1471/4885CRBN 300/4885

“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.