SCHEMBL20325131

SCHEMBL20325131

CC(C)c1ccc(C#CCOCCCOCC(C)(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.35
▸ HTR2A P28223 4/20 0.34
▸ HTR2C P28335 4/20 0.34
▸ HTR2B P41595 4/20 0.34
▸ SIGMAR1 Q99720 4/20 0.34
▸ DRD2 P14416 3/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ ACACB O00763 2/20 0.32
▸ SLC6A4 P31645 2/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL18612041 0.89 HTR2A (0.33) HTR2AHTR2CHTR2BSIGMAR1DRD2
SCHEMBL24920843 0.87 ACACB (0.33) HTR2AHTR2CHTR2BSIGMAR1DRD2
SCHEMBL26328562 0.86 ACACB (0.33) HTR2AHTR2CHTR2BSIGMAR1DRD2
SCHEMBL18591766 0.86 ACACB (0.33) HTR2AHTR2CHTR2BSIGMAR1DRD2
SCHEMBL21214839 0.83 GRM5 (0.36) GRM5HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL22964321 0.81 GRM5 (0.37) GRM5HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL21214847 0.80 GRM5 (0.34) GRM5KCNH2ACACBALOX5
SCHEMBL18591869 0.79 ACACB (0.37) ACACBKMT2A
SCHEMBL18591870 0.78 ACACB (0.40) ACACBMEN1KMT2A
SCHEMBL20133291 0.75 ACACB (0.33) ACACB

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-10844021-B2 Compounds and methods for the targeted degradation of androgen receptor ARVINAS OPERATIONS, INC. (US) 2020-11-24 — — US disclosed
US-10723717-B2 Compounds and methods for the targeted degradation of rapidly accelerated fibrosarcoma polypeptides ARVINAS OPERATIONS, INC. (US) 2020-07-28 — — US disclosed
US-20200155689-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME ARVINAS OPERATIONS, INC. 2020-05-21 — — US disclosed
US-20180179183-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES ARVINAS OPERATIONS, INC. 2018-06-28 — — 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-20180179183-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES CRBN, ARAF, VHL GRM5 4731/4885HTR2A 3808/4885HTR2C 4090/4885
US-10844021-B2 Compounds and methods for the targeted degradation of androgen receptor AR, ADRM1, CRBN GRM5 630/4885HTR2A 1229/4885HTR2C 939/4885
US-20200155689-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME CRBN, CBL, MDM2 GRM5 3132/4885HTR2A 4021/4885HTR2C 4128/4885
US-10723717-B2 Compounds and methods for the targeted degradation of rapidly accelerated fibrosarcoma polypeptides CRBN, ARAF, VHL GRM5 4731/4885HTR2A 3808/4885HTR2C 4090/4885

“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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