SCHEMBL3588320

SCHEMBL3588320

CN(C)CC(=O)NCC(=O)OCN1C(=O)CCC(N2C(=O)c3ccccc3C2=O)C1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
USP2 O75604 1/20 0.41
CYP3A4 P08684 2/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
DDB1 Q16531 3/20 0.36
CRBN Q96SW2 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 1/20 0.36
AGTR1 P30556 1/20 0.35
CHRM2 P08172 1/20 0.34
OPRM1 P35372 1/20 0.34
IKZF3 Q9UKT9 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 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
SCHEMBL3593651 0.91 ALDH1A1 (0.41) ALDH1A1USP2CYP3A4POLBL3MBTL1
SCHEMBL13167679 0.89 L3MBTL1 (0.41) ALDH1A1L3MBTL1DDB1CRBNTDP1
Hydrochloric Acid SCHEMBL2910258 0.88 L3MBTL1 (0.41) ALDH1A1L3MBTL1DDB1CRBNTDP1
SCHEMBL3583758 0.87 CYP3A4 (0.42) ALDH1A1USP2CYP3A4POLBDDB1
Hydrochloric Acid SCHEMBL7741745 0.87 ALDH1A1 (0.41) ALDH1A1USP2CYP3A4POLBDDB1
SCHEMBL3583970 0.85 L3MBTL1 (0.36) ALDH1A1L3MBTL1DDB1CRBNTDP1
SCHEMBL3599942 0.85 USP2 (0.41) ALDH1A1USP2CYP3A4POLBL3MBTL1
SCHEMBL7736189 0.84 DDB1 (0.45) ALDH1A1USP2CYP3A4POLBDDB1
SCHEMBL3588455 0.84 L3MBTL1 (0.36) ALDH1A1CYP3A4L3MBTL1DDB1CRBN
SCHEMBL3588459 0.84 L3MBTL1 (0.36) ALDH1A1CYP3A4L3MBTL1DDB1CRBN

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 ALDH1A1 2635/4885USP2 485/4885CYP3A4 958/4885

“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.