SCHEMBL21341632

SCHEMBL21341632

CCC(=O)COCCCOCCCOc1ccc([C@@H](C)NC(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 11/20 0.46
▸ ACACA Q13085 7/20 0.46
▸ HPGD P15428 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ PLA2G4B P0C869 3/20 0.43

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
SCHEMBL21025835 0.90 ACACB (0.44) ACACBACACAHPGDLMNAPLA2G4B
SCHEMBL20372470 0.89 ACACB (0.46) ACACBACACAHPGDLMNAPLA2G4B
SCHEMBL24788112 0.88 ACACB (0.46) ACACBACACAHPGDLMNAPLA2G4B
SCHEMBL20325827 0.87 ACACB (0.44) ACACBACACAHPGDLMNA
SCHEMBL18592240 0.86 HPGD (0.43) ACACBACACAHPGDLMNA
SCHEMBL21664495 0.82 PLA2G4B (0.44) ACACBLMNAPLA2G4B
SCHEMBL20234740 0.81 PLA2G4B (0.46) PLA2G4B
SCHEMBL20331331 0.81 PLA2G4B (0.46) PLA2G4B
SCHEMBL24762096 0.80 APP (0.48) PLA2G4B
SCHEMBL21982825 0.79 PLA2G4B (0.49) PLA2G4B

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-11236051-B2 Compounds and methods for the targeted degradation of androgen receptor ARVINAS OPERATIONS, INC. (US) 2022-02-01 — — US disclosed
US-11028088-B2 Modulators of BTK proteolysis and methods of use YALE UNIVERSITY (US) 2021-06-08 — — US disclosed
US-20210009528-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas, Inc. 2021-01-14 — — US disclosed
US-20190276459-A1 MODULATORS OF BTK PROTEOLYSIS AND METHODS OF USE YALE UNIVERSITY 2019-09-12 — — 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 (4 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-20210009528-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN ACACB 1444/4885ACACA 1820/4885HPGD 3040/4885
US-11236051-B2 Compounds and methods for the targeted degradation of androgen receptor AR, ADRM1, CRBN ACACB 1444/4885ACACA 1820/4885HPGD 3040/4885
US-11028088-B2 Modulators of BTK proteolysis and methods of use BTK, CBL, CRBN ACACB 1780/4885ACACA 2749/4885HPGD 4471/4885
US-20190276459-A1 MODULATORS OF BTK PROTEOLYSIS AND METHODS OF USE BTK, CBL, CRBN ACACB 1780/4885ACACA 2749/4885HPGD 4471/4885

“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