SCHEMBL26559935

SCHEMBL26559935

BOCc1ccc(NC(=O)[C@H](CCCCN(C)C)NC(=O)C2(C(=O)NCCCCCN3C(=O)C=CC3=O)CCC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.36
▸ OPRD1 P41143 2/20 0.36
▸ OPRK1 P41145 2/20 0.36
▸ SIRT2 Q8IXJ6 12/20 0.36
▸ SIRT1 Q96EB6 12/20 0.36
▸ SIRT3 Q9NTG7 4/20 0.36
▸ SIRT5 Q9NXA8 3/20 0.34
▸ AVPR1A P37288 1/20 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
SCHEMBL20831162 0.90 SIRT2 (0.36) SIRT2SIRT1SIRT3SIRT5
SCHEMBL25413079 0.90 HDAC3 (0.36) OPRM1OPRD1OPRK1SIRT2SIRT1
SCHEMBL20830828 0.89 SIRT2 (0.34) OPRM1OPRD1OPRK1SIRT2SIRT1
SCHEMBL22698653 0.84 SIRT2 (0.36) SIRT2SIRT1SIRT3SIRT5
SCHEMBL22698603 0.83 SIRT2 (0.35) OPRM1OPRD1OPRK1SIRT2SIRT1
SCHEMBL19683931 0.81 SIRT2 (0.37) SIRT2SIRT1SIRT3SIRT5
SCHEMBL18332122 0.81 PLG (0.38) OPRM1OPRD1OPRK1SIRT2SIRT1
SCHEMBL28953170 0.81 SIRT2 (0.38) SIRT2SIRT1SIRT3SIRT5
SCHEMBL20831135 0.81 KLKB1 (0.35) SIRT2SIRT1SIRT3SIRT5
SCHEMBL17813693 0.80 RAB9A (0.36) OPRM1OPRD1OPRK1SIRT2SIRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230330249-A1 ANTIBODY-CONJUGATED CHEMICAL INDUCERS OF DEGRADATION OF BRM AND METHODS THEREOF GENENTECH, INC. (US) 2023-10-19 — — 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 (1 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-20230330249-A1 ANTIBODY-CONJUGATED CHEMICAL INDUCERS OF DEGRADATION OF BRM AND METHODS THEREOF ADRM1, CD79B, BRDT OPRM1 2454/4885OPRD1 4739/4885OPRK1 4586/4885

“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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