SCHEMBL20317554

SCHEMBL20317554

CCC(=O)COCCOCCOCCOCCOCCOC

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.39
CA2 P00918 1/20 0.34
NAMPT P43490 1/20 0.34
CES2 O00748 2/20 0.33
CYP3A4 P08684 2/20 0.33
ABCB11 O95342 1/20 0.33
ADRA2B P18089 1/20 0.33
OPRD1 P41143 1/20 0.33
SCN5A Q14524 1/20 0.33
TSHR P16473 3/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL14403358 1.00 TDP1 (0.39) TDP1CA2NAMPTCES2CYP3A4
SCHEMBL8390457 1.00 TDP1 (0.39) TDP1CA2NAMPTCES2CYP3A4
SCHEMBL8390936 0.98 TDP1 (0.41) TDP1CA2NAMPTCES2CYP3A4
SCHEMBL11956756 0.93 TDP1 (0.38) TDP1NAMPTCES2TSHRALDH1A1
SCHEMBL19170656 0.84 TDP1 (0.41) TDP1CES2CYP3A4TSHRALDH1A1
SCHEMBL7243144 0.82 MEN1 (0.50) TDP1CES2CYP3A4TSHRALDH1A1
SCHEMBL22856291 0.82 CES2 (0.52) TDP1CES2TSHRALDH1A1
SCHEMBL15223140 0.82 TDP1 (0.39) TDP1CA2CYP3A4ABCB11ADRA2B
SCHEMBL20317552 0.80 CES2 (0.50) TDP1CES2CYP3A4TSHRALDH1A1
SCHEMBL16421150 0.80 TDP1 (0.38) TDP1CES2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834460-B2 Imide-based modulators of proteolysis and associated methods of use YALE UNIVERSITY (US) 2023-12-05 US disclosed
US-20180177750-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ENHANCER OF ZESTE HOMOLOG 2 POLYPEPTIDE 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 (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-20180177750-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ENHANCER OF ZESTE HOMOLOG 2 POLYPEPTIDE CRBN, MDM2, VHL TDP1 2137/4885CA2 4176/4885NAMPT 4168/4885
US-11834460-B2 Imide-based modulators of proteolysis and associated methods of use CRBN, MDM2, UBE2N TDP1 1896/4885CA2 2225/4885NAMPT 4018/4885

“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.