SCHEMBL20919946

SCHEMBL20919946

NCCCCCCCCOc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 19/20 0.61
DDB1 Q16531 14/20 0.61
ALDH1A1 P00352 1/20 0.56
CHRM2 P08172 1/20 0.56
OPRM1 P35372 1/20 0.56
IKZF3 Q9UKT9 1/20 0.56
CYP1A2 P05177 1/20 0.56
TSHR P16473 1/20 0.56
TDP1 Q9NUW8 1/20 0.56

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
SCHEMBL26147866 1.00 CRBN (0.61) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL19475485 0.99 CRBN (0.62) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29669581 0.99 CRBN (0.62) CRBNDDB1ALDH1A1CHRM2OPRM1
Hydrochloric Acid SCHEMBL31307049 0.94 CRBN (0.62) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL23705654 0.92 CRBN (0.65) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29617032 0.92 CRBN (0.65) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29426741 0.90 CRBN (0.59) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25207204 0.90 CRBN (0.59) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL25211098 0.90 CRBN (0.62) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL22346816 0.89 CRBN (0.61) CRBNDDB1ALDH1A1CHRM2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11505560-B2 Heterobifunctional compounds with improved specificity DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-11-22 US disclosed
US-20210130368-A1 HETEROBIFUNCTIONAL COMPOUNDS WITH IMPROVED SPECIFICITY DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-05-06 US disclosed
US-20210130368-A1 HETEROBIFUNCTIONAL COMPOUNDS WITH IMPROVED SPECIFICITY DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-05-06 US disclosed
EP-3676268-A1 HETEROBIFUNCTIONAL COMPOUNDS WITH IMPROVED SPECIFICITYFOR THE BROMODOMAIN OF BRD4 Dana-Farber Cancer Institute, Inc. (US) 2020-07-08 EP disclosed
WO-2019079701-A1 HETEROBIFUNCTIONAL COMPOUNDS WITH IMPROVED SPECIFICITYFOR THE BROMODOMAIN OF BRD4 DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-04-25 WO disclosed
WO-2019079701-A1 HETEROBIFUNCTIONAL COMPOUNDS WITH IMPROVED SPECIFICITYFOR THE BROMODOMAIN OF BRD4 DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-04-25 WO 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-20210130368-A1 HETEROBIFUNCTIONAL COMPOUNDS WITH IMPROVED SPECIFICITY MDM2, STUB1, UBE3C CRBN 113/4885DDB1 249/4885ALDH1A1 2248/4885
US-11505560-B2 Heterobifunctional compounds with improved specificity MDM2, STUB1, UBE3C CRBN 113/4885DDB1 249/4885ALDH1A1 2248/4885

“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.