SCHEMBL3589258

SCHEMBL3589258

O=C(CN1CCOCC1)OCN1C(=O)CCC(N2C(=O)c3ccccc3C2=O)C1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 6/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 1/20 0.39
LMNA P02545 2/20 0.38
MAP1LC3B Q9GZQ8 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CHRM2 P08172 1/20 0.37
OPRM1 P35372 1/20 0.37
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
IKZF3 Q9UKT9 1/20 0.37

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 SCHEMBL3593448 0.99 KMT2A (0.43) KMT2AMEN1POLBMAPK1ALDH1A1
SCHEMBL3595909 0.90 KMT2A (0.42) KMT2AMEN1ALDH1A1SMN1; SMN2MAP1LC3B
Hydrochloric Acid SCHEMBL3584967 0.89 KMT2A (0.41) KMT2AMEN1ALDH1A1SMN1; SMN2MAP1LC3B
SCHEMBL24921833 0.83 ALDH1A1 (0.38) KMT2AMEN1ALDH1A1SMN1; SMN2MAP1LC3B
SCHEMBL3592001 0.83 ALDH1A1 (0.41) KMT2AMEN1ALDH1A1MAP1LC3BNPSR1
SCHEMBL2918755 0.83 ALDH1A1 (0.41) KMT2AMEN1ALDH1A1MAP1LC3BNPSR1
SCHEMBL845283 0.82 ALDH1A1 (0.51) KMT2AMEN1MAPK1ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL7740778 0.82 ALDH1A1 (0.40) KMT2AMEN1ALDH1A1MAP1LC3BNPSR1
SCHEMBL5478671 0.81 ALDH1A1 (0.43) KMT2AMEN1ALDH1A1L3MBTL1CHRM2
SCHEMBL3599942 0.81 USP2 (0.41) KMT2AMEN1POLBALDH1A1LMNA

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 KMT2A 1947/4885MEN1 1687/4885POLB 4014/4885

“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.