SCHEMBL19447831

SCHEMBL19447831

COCCNC(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 4/20 0.46
▸ MDM2 Q00987 1/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ MDM4 O15151 1/20 0.42
▸ TP53 P04637 1/20 0.42

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
SCHEMBL26232024 0.95 TLR2 (0.45) TLR2MDM2PTPN1
SCHEMBL31648943 0.95 TLR2 (0.45) TLR2MDM2PTPN1
SCHEMBL29716733 0.95 TLR2 (0.45) TLR2MDM2PTPN1
SCHEMBL31631998 0.95 TLR2 (0.45) TLR2MDM2PTPN1
SCHEMBL31557564 0.90 TLR2 (0.46) TLR2MDM2KMT2APTPN1
SCHEMBL16757656 0.90 TLR2 (0.46) TLR2MDM2KMT2APTPN1
SCHEMBL16757654 0.90 TLR2 (0.46) TLR2MDM2KMT2APTPN1
SCHEMBL29358858 0.90 TLR2 (0.46) TLR2MDM2PTPN1MDM4TP53
SCHEMBL17322760 0.90 TLR2 (0.47) TLR2MDM2PTPN1
SCHEMBL29083314 0.90 TLR2 (0.45) TLR2MDM2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912997-B2 RNAi agents for inhibiting expression of Superoxide Dismutase 1 (SOD1), compositions thereof, and methods of use Arrowhead Pharmaceuticals, Inc. (US) 2024-02-27 — — US disclosed
US-20240026363-A1 RNAi Agents for Inhibiting Expression of Superoxide Dismutase 1 (SOD1), Compositions Thereof, and Methods of Use SIXTH STREETLENDING PARTNERS, AS THE ADMINISTRATIVE AGENT 2024-01-25 — — US disclosed
US-20170290925-A1 Conjugates And Conjugating Reagents POLYTHERICS LIMITED (GB) 2017-10-12 — — 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 (3 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-11912997-B2 RNAi agents for inhibiting expression of Superoxide Dismutase 1 (SOD1), compositions thereof, and methods of use SOD1, SOD3, SMN1; SMN2 TLR2 4072/4885MDM2 493/4885KMT2A 2125/4885
US-20170290925-A1 Conjugates And Conjugating Reagents ANPEP, NGLY1, PCTP TLR2 3035/4885MDM2 2441/4885KMT2A 3168/4885
US-20240026363-A1 RNAi Agents for Inhibiting Expression of Superoxide Dismutase 1 (SOD1), Compositions Thereof, and Methods of Use SOD1, SOD3, SMN1; SMN2 TLR2 4034/4885MDM2 480/4885KMT2A 2169/4885

“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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