SCHEMBL21458463

SCHEMBL21458463

Cc1cc(C(CCOCCOCCBr)C(=O)O)on1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
VHL P40337 1/20 0.33
POLB P06746 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
TSHR P16473 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
SCHEMBL21458717 1.00 PPARG (0.36) PPARGPPARAHCAR2ALDH1A1SMN1; SMN2
SCHEMBL28623109 0.77 HCAR2 (0.44) PPARGPPARAHCAR2ALDH1A1SMN1; SMN2
SCHEMBL28623572 0.77 KDM4E (0.42) PPARGPPARAALDH1A1SMN1; SMN2POLB
SCHEMBL30179086 0.75 PPARA (0.42) PPARGPPARAHCAR2ALDH1A1SMN1; SMN2
SCHEMBL28611486 0.74 HCAR2 (0.47) PPARGPPARAHCAR2ALDH1A1SMN1; SMN2
SCHEMBL21876788 0.72 KDM4E (0.42) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL21876794 0.72 KDM4E (0.42) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL21876965 0.72 KDM4E (0.42) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL21876747 0.70 HCAR2 (0.43) PPARGPPARAHCAR2ALDH1A1SMN1; SMN2
SCHEMBL28521574 0.68 HCAR2 (0.33) HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12552783-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2026-02-17 US disclosed
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2022-12-22 US disclosed
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2022-12-22 US disclosed
US-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 US disclosed
US-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 US disclosed
EP-3774777-A2 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE Arvinas Operations, Inc. (US) 2021-02-17 EP disclosed
CN-112218859-A Modulators of proteolysis and related methods of use 阿尔维纳斯运营股份有限公司 2021-01-12 CN disclosed
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2019-10-17 US disclosed
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2019-10-17 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-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL PPARG 4298/4885PPARA 4363/4885HCAR2 3946/4885
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL PPARG 4298/4885PPARA 4363/4885HCAR2 3946/4885
US-12552783-B2 Modulators of proteolysis and associated methods of use CRBN, ADRM1, MDM2 PPARG 4101/4885PPARA 4139/4885HCAR2 4050/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL PPARG 4298/4885PPARA 4363/4885HCAR2 3946/4885

“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.