SCHEMBL20046520

SCHEMBL20046520

CCNCCCCCOCCCOCC(=O)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 2/20 0.39
▸ CYP2C19 P33261 3/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ KDM1A O60341 1/20 0.34
▸ SAT1 P21673 2/20 0.34
▸ EPHX2 P34913 7/20 0.34
▸ ADRB2 P07550 1/20 0.33
▸ ADRB3 P13945 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL21162387 0.97 CES2 (0.41) CES2CYP2C19CYP1A2KDM1ASAT1
SCHEMBL20372780 0.90 MEN1 (0.36) CES2CYP2C19SAT1EPHX2MEN1
SCHEMBL20234530 0.90 SAT1 (0.39) CES2CYP2C19CYP1A2SAT1MEN1
SCHEMBL18611819 0.84 CYP2C19 (0.38) CES2CYP2C19EPHX2MEN1KMT2A
SCHEMBL23560102 0.83 MEN1 (0.42) SAT1MEN1KMT2A
SCHEMBL21472752 0.83 MEN1 (0.42) SAT1MEN1KMT2A
SCHEMBL19414211 0.83 MEN1 (0.42) SAT1MEN1KMT2A
SCHEMBL23695749 0.83 MEN1 (0.36) CYP2C19SAT1MEN1GLAKMT2A
SCHEMBL18592232 0.83 KDM4E (0.38) CES2CYP2C19CYP1A2EPHX2
SCHEMBL20133313 0.81 SAT1 (0.39) CYP2C19CYP1A2SAT1EPHX2MEN1

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-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2021-07-20 — — US disclosed
US-20190151295-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES ARVINAS OPERATIONS, INC. 2019-05-23 — — US disclosed
US-20180099940-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2018-04-12 — — 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 (3 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-20190151295-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 POLYPEPTIDES IRAK1, IRAK4, IRAK2 CES2 4048/4885CYP2C19 4868/4885CYP1A2 4845/4885
US-11065231-B2 Compounds and methods for the targeted degradation of interleukin-1 receptor- associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 CES2 4048/4885CYP2C19 4868/4885CYP1A2 4845/4885
US-20180099940-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN CES2 1066/4885CYP2C19 3987/4885CYP1A2 2175/4885

“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