SCHEMBL19954310

SCHEMBL19954310

Cc1nc2ccc(N)cc2c(=O)n1C1(C(=O)OCc2ccccc2)CCC(=O)NC1=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 2/20 0.48
▸ DDB1 Q16531 1/20 0.48
▸ ALDH1A1 P00352 5/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ HPGD P15428 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ PDE4D Q08499 1/20 0.35
▸ DHFR P00374 3/20 0.34
▸ TNF P01375 1/20 0.34
▸ LMNA P02545 2/20 0.34
▸ ENPP2 Q13822 1/20 0.33
▸ ATXN2 Q99700 1/20 0.33
▸ SCD O00767 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP1A1 P04798 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP1B1 Q16678 1/20 0.33

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
SCHEMBL19953921 1.00 CRBN (0.48) CRBNDDB1ALDH1A1KDM4EHPGD
SCHEMBL19953924 1.00 CRBN (0.48) CRBNDDB1ALDH1A1KDM4EHPGD
SCHEMBL23979364 0.95 DDB1 (0.44) CRBNDDB1ALDH1A1KDM4EHPGD
SCHEMBL19954318 0.94 DDB1 (0.47) CRBNDDB1ALDH1A1KDM4EHPGD
SCHEMBL19953920 0.94 DDB1 (0.47) CRBNDDB1ALDH1A1KDM4EHPGD
SCHEMBL19953919 0.94 DDB1 (0.47) CRBNDDB1ALDH1A1KDM4EHPGD
SCHEMBL19954314 0.91 CRBN (0.47) CRBNDDB1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL19953923 0.91 CRBN (0.47) CRBNDDB1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL19953927 0.91 CRBN (0.47) CRBNDDB1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL19953932 0.90 CRBN (0.50) CRBNDDB1ALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200360382-A1 3-(SUBSTITUTED-4-OXOQUINAZOLIN-3(4H)-YL)-3-DEUTERO-PIPERIDINE-2,6-DIONE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME DEUTERX, LLC 2020-11-19 — — US disclosed
US-10555946-B2 3-(substituted-4-oxoquinazolin-3(4H)-yl)-3-deutero-piperidine-2,6-dione derivatives and compositions comprising and methods of using the same DEUTERX, LLC (US) 2020-02-11 — — US disclosed
US-9913845-B2 3-(substituted-4-oxoquinazolin-3(4H)-yl)-3-deutero-piperidine-2,6-dione derivatives and compositions comprising and methods of using the same DEUTERX, LLC (US) 2018-03-13 — — 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-10555946-B2 3-(substituted-4-oxoquinazolin-3(4H)-yl)-3-deutero-piperidine-2,6-dione derivatives and compositions comprising and methods of using the same AQP3, AQP4, AQP1 CRBN 2849/4885DDB1 3771/4885ALDH1A1 1102/4885
US-20200360382-A1 3-(SUBSTITUTED-4-OXOQUINAZOLIN-3(4H)-YL)-3-DEUTERO-PIPERIDINE-2,6-DIONE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME AQP3, AQP4, AQP1 CRBN 2849/4885DDB1 3771/4885ALDH1A1 1102/4885

“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.

Send feedback