SCHEMBL21458802

SCHEMBL21458802

CN(CCOCCOCCOCCO)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 5/20 0.39
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
KDM4E B2RXH2 7/20 0.36
RAB9A P51151 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33

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
SCHEMBL21069994 1.00 MEN1 (0.46) MEN1KMT2ABLMPMP22HSD17B10
SCHEMBL21069229 1.00 MEN1 (0.46) MEN1KMT2ABLMPMP22HSD17B10
SCHEMBL17555598 0.98 TSHR (0.43) MEN1KMT2ABLMPMP22HSD17B10
SCHEMBL22631509 0.86 TSHR (0.45) MEN1KMT2ABLMPMP22HSD17B10
SCHEMBL28849721 0.83 BLM (0.42) MEN1KMT2ABLMPMP22HSD17B10
SCHEMBL21070273 0.82 BLM (0.41) MEN1KMT2ABLMPMP22HSD17B10
SCHEMBL21071250 0.82 BLM (0.41) MEN1KMT2ABLMPMP22HSD17B10
SCHEMBL931842 0.82 BLM (0.41) MEN1KMT2ABLMPMP22HSD17B10
SCHEMBL21001064 0.80 KDM4E (0.37) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL25363263 0.79 BLM (0.38) MEN1KMT2ABLMPMP22HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242506-A1 HETEROBIFUNCTIONAL MOLECULES AS TEAD INHIBITORS GENENTECHT, INC. (US) 2023-08-03 US disclosed
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2023-07-25 US disclosed
EP-4114830-A1 HETEROBIFUNCTIONAL MOLECULES AS TEAD INHIBITORS Genentech, Inc. (US) 2023-01-11 EP 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
US-20200085793-A1 MODULATORS OF ALPHA-SYNUCLEIN PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2020-03-19 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 (5 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 MEN1 2058/4885KMT2A 1443/4885BLM 1454/4885
US-20200085793-A1 MODULATORS OF ALPHA-SYNUCLEIN PROTEOLYSIS AND ASSOCIATED METHODS OF USE UCHL1, ADRM1, CRBN MEN1 3483/4885KMT2A 2032/4885BLM 2625/4885
US-20230242506-A1 HETEROBIFUNCTIONAL MOLECULES AS TEAD INHIBITORS TEAD1, TEAD2, TEAD4 MEN1 2876/4885KMT2A 2290/4885BLM 976/4885
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use UCHL1, ADRM1, CRBN MEN1 3483/4885KMT2A 2032/4885BLM 2625/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL MEN1 2058/4885KMT2A 1443/4885BLM 1454/4885

“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.