SCHEMBL23979408

SCHEMBL23979408

O=C1CCC[C@@H](N2C(=O)c3ccccc3C2=O)C(=O)N1

nearest known ligand 0.82

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 18/20 0.82
DDB1 Q16531 14/20 0.82
IKZF3 Q9UKT9 2/20 0.82
ALDH1A1 P00352 1/20 0.82
CHRM2 P08172 1/20 0.82
OPRM1 P35372 1/20 0.82
CYP1A2 P05177 1/20 0.82
TSHR P16473 1/20 0.82
TDP1 Q9NUW8 1/20 0.82
TNF P01375 1/20 0.62
IL1B P01584 1/20 0.62
TBXA2R P21731 1/20 0.62
IKZF1 Q13422 1/20 0.62

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
SCHEMBL17973300 1.00 CRBN (0.82) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL18263934 1.00 CRBN (0.82) CRBNDDB1IKZF3ALDH1A1CHRM2
Thalidomide SCHEMBL28144673 0.91 CRBN (0.88) CRBNDDB1IKZF3ALDH1A1CHRM2
Thalidomide SCHEMBL455269 0.90 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
Thalidomide SCHEMBL410642 0.90 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
Thalidomide SCHEMBL41641 0.90 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
Thalidomide SCHEMBL411178 0.90 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
Thalidomide SCHEMBL571278 0.90 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
Thalidomide SCHEMBL7581 0.90 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
Thalidomide SCHEMBL411175 0.90 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773080-B2 Deuterium-enriched isoindolinonyl-azepanediones and related compounds and methods of treating medical disorders using same SALARIUS PHARMACEUTICALS, INC. (US) 2023-10-03 US disclosed
US-20210340125-A1 DEUTERIUM-ENRICHED ISOINDOLINONYL-AZEPANEDIONES AND RELATED COMPOUNDS AND METHODS OF TREATING MEDICAL DISORDERS USING SAME SALARIUS PHARMACEUTICALS, INC. 2021-11-04 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 (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-11773080-B2 Deuterium-enriched isoindolinonyl-azepanediones and related compounds and methods of treating medical disorders using same HPGDS, HPGD, AQP3 CRBN 1079/4885DDB1 690/4885IKZF3 318/4885
US-20210340125-A1 DEUTERIUM-ENRICHED ISOINDOLINONYL-AZEPANEDIONES AND RELATED COMPOUNDS AND METHODS OF TREATING MEDICAL DISORDERS USING SAME HPGDS, HPGD, AQP3 CRBN 1079/4885DDB1 690/4885IKZF3 318/4885

“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.