SCHEMBL20987910

SCHEMBL20987910

O=C1CC[C@@](O)(N2C(=O)c3ccccc3C2=O)C(=O)N1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 10/20 0.50
▸ DDB1 Q16531 5/20 0.50
▸ ALDH1A1 P00352 4/20 0.43
▸ TSHR P16473 2/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ IKZF3 Q9UKT9 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD17B10 Q99714 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
SCHEMBL680390 0.77 CRBN (0.47) CRBNDDB1ALDH1A1TSHRCHRM2
SCHEMBL30184407 0.77 CRBN (0.72) CRBNDDB1ALDH1A1TSHRCHRM2
SCHEMBL5515897 0.77 CRBN (0.72) CRBNDDB1ALDH1A1TSHRCHRM2
SCHEMBL24379329 0.77 CRBN (0.47) CRBNDDB1ALDH1A1TSHRCHRM2
SCHEMBL17552856 0.77 CRBN (0.72) CRBNDDB1ALDH1A1TSHRCHRM2
SCHEMBL24411108 0.77 CRBN (0.47) CRBNDDB1ALDH1A1TSHRCHRM2
SCHEMBL17169674 0.77 CRBN (0.72) CRBNDDB1ALDH1A1TSHRCHRM2
SCHEMBL17865988 0.74 PARP1 (0.40) ALDH1A1TSHROPRM1TDP1
SCHEMBL12041950 0.74 CRBN (0.44) CRBNDDB1ALDH1A1TSHRCHRM2
SCHEMBL23979399 0.72 CRBN (0.42) CRBNDDB1ALDH1A1TSHRCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190133985-A1 COMPOSITIONS AND METHODS FOR USE OF EFLORNITHINE AND DERIVATIVES AND ANALOGS THEREOF TO TREAT CANCERS, INCLUDING GLIOMAS Orbus Therapeutics, Inc. 2019-05-09 — — 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-20190133985-A1 COMPOSITIONS AND METHODS FOR USE OF EFLORNITHINE AND DERIVATIVES AND ANALOGS THEREOF TO TREAT CANCERS, INCLUDING GLIOMAS AHCY, SRM, MAT2A CRBN 3099/4885DDB1 1996/4885ALDH1A1 585/4885

“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.

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