SCHEMBL21214839

SCHEMBL21214839

CC(C)COCCCOCC#Cc1ccc(C(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.36
▸ ACACB O00763 5/20 0.35
▸ KCNH2 Q12809 1/20 0.34
▸ SLC6A4 P31645 2/20 0.33
▸ HTR2A P28223 3/20 0.33
▸ HTR2C P28335 3/20 0.33
▸ HTR2B P41595 3/20 0.33
▸ SIGMAR1 Q99720 3/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ DRD2 P14416 2/20 0.32
▸ IDO1 P14902 1/20 0.30
▸ MMP2 P08253 1/20 0.30
▸ MMP12 P39900 1/20 0.30

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
SCHEMBL22964321 0.84 GRM5 (0.37) GRM5ACACBKCNH2SLC6A4HTR2A
SCHEMBL20325131 0.83 GRM5 (0.35) GRM5ACACBKCNH2SLC6A4HTR2A
SCHEMBL18591870 0.81 ACACB (0.40) ACACBMEN1KMT2AMMP2MMP12
SCHEMBL25053676 0.79 ACACB (0.36) GRM5ACACBKCNH2ALOX5MEN1
SCHEMBL18591869 0.76 ACACB (0.37) ACACBKMT2AMMP2MMP12
SCHEMBL19036905 0.74 GRM5 (0.43) GRM5ACACBKCNH2HTR2AIDO1
SCHEMBL20324201 0.73 ACACB (0.39) ACACB
SCHEMBL19316732 0.73 HTR2A (0.50) KCNH2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL19604932 0.72 ACACB (0.38) ACACB
SCHEMBL18551213 0.72 ACACB (0.34) ACACBKCNH2

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-11384063-B2 Modulators of estrogen receptor proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2022-07-12 — — US disclosed
US-20200199107-A1 MODULATORS OF ESTROGEN RECEPTOR PROTEOLYSIS AND ASSOCIATED METHODS OF USE Arvinas, Inc. 2020-06-25 — — US disclosed
US-20190233433-A1 IMIDE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2019-08-01 — — 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-11384063-B2 Modulators of estrogen receptor proteolysis and associated methods of use ADRM1, MDM2, ESR2 GRM5 1204/4885ACACB 1591/4885KCNH2 4852/4885
US-20190233433-A1 IMIDE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE CRBN, MDM2, UBE2N GRM5 3195/4885ACACB 3977/4885KCNH2 4858/4885
US-20200199107-A1 MODULATORS OF ESTROGEN RECEPTOR PROTEOLYSIS AND ASSOCIATED METHODS OF USE ADRM1, MDM2, ESR2 GRM5 1204/4885ACACB 1591/4885KCNH2 4852/4885

“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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