SCHEMBL21771120

SCHEMBL21771120

CNCCOCCOCCOCCOc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
CRBN Q96SW2 15/20 0.54
DDB1 Q16531 12/20 0.54
ALDH1A1 P00352 1/20 0.52
CHRM2 P08172 1/20 0.52
OPRM1 P35372 1/20 0.52
IKZF3 Q9UKT9 1/20 0.52
CYP1A2 P05177 1/20 0.52
TSHR P16473 1/20 0.52
TDP1 Q9NUW8 1/20 0.52

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
SCHEMBL25941394 1.00 MAPT (0.55) MAPTCRBNDDB1ALDH1A1CHRM2
SCHEMBL25937409 1.00 MAPT (0.55) MAPTCRBNDDB1ALDH1A1CHRM2
SCHEMBL21472007 1.00 MAPT (0.55) MAPTCRBNDDB1ALDH1A1CHRM2
SCHEMBL25937530 1.00 MAPT (0.55) MAPTCRBNDDB1ALDH1A1CHRM2
Hydrochloric Acid SCHEMBL21458445 0.99 MAPT (0.54) MAPTCRBNDDB1ALDH1A1CHRM2
Hydrochloric Acid SCHEMBL21820362 0.99 MAPT (0.54) MAPTCRBNDDB1ALDH1A1CHRM2
Hydrochloric Acid SCHEMBL29137577 0.99 MAPT (0.54) MAPTCRBNDDB1ALDH1A1CHRM2
Hydrochloric Acid SCHEMBL30075404 0.99 MAPT (0.54) MAPTCRBNDDB1ALDH1A1CHRM2
Hydrochloric Acid SCHEMBL30011876 0.99 MAPT (0.54) MAPTCRBNDDB1ALDH1A1CHRM2
Hydrochloric Acid SCHEMBL30011295 0.99 MAPT (0.54) MAPTCRBNDDB1ALDH1A1CHRM2

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 5 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-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
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2023-07-25 US disclosed
WO-2020041331-A1 PROTEOLYSIS TARGETING CHIMERIC (PROTAC) COMPOUND WITH E3 UBIQUITIN LIGASE BINDING ACTIVITY AND TARGETING ALPHA-SYNUCLEIN PROTEIN FOR TREATING NEURODEGENERATIVE DISEASES ARVINAS OPERATIONS, INC. (US) 2020-02-27 WO 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 (2 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-20230242506-A1 HETEROBIFUNCTIONAL MOLECULES AS TEAD INHIBITORS TEAD1, TEAD2, TEAD4 MAPT 507/4885CRBN 2808/4885DDB1 750/4885
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use UCHL1, ADRM1, CRBN MAPT 741/4885CRBN 3/4885DDB1 434/4885

“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.