SCHEMBL29521888

SCHEMBL29521888

CC(C)(C)OC(=O)[C@H](CCCCNC(=O)CCCc1ccc(I)cc1)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 9/20 0.44
▸ TLR2 O60603 3/20 0.42
▸ TLR1 Q15399 1/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ CA9 Q16790 1/20 0.39
▸ MDM2 Q00987 1/20 0.37
▸ KLK7 P49862 1/20 0.37
▸ KLK5 Q9Y337 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL29521884 0.94 TLR2 (0.41) ALBTLR2TLR1MDM2
SCHEMBL22021730 0.92 TLR2 (0.41) ALBTLR2TLR1KMT2AMDM2
SCHEMBL31298693 0.92 ALB (0.48) ALBTLR2TLR1CA9
SCHEMBL20530026 0.91 ALB (0.53) ALBTLR2KMT2ACA9MDM2
SCHEMBL20530037 0.90 ALB (0.47) ALBTLR2CA9MDM2
SCHEMBL31298675 0.90 ALB (0.47) ALBTLR2CA9MDM2
SCHEMBL31298682 0.89 PTPN1 (0.41) TLR2TLR1KMT2A
SCHEMBL20450572 0.88 KMT2A (0.49) TLR2TLR1KMT2AMDM2KLK7
SCHEMBL20450575 0.88 KMT2A (0.57) TLR2TLR1KMT2AMEN1ALDH1A1
SCHEMBL20450573 0.88 KMT2A (0.57) TLR2TLR1KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12377175-B2 Trifunctional constructs with tunable pharmacokinetics useful in imaging and anti-tumor therapies CORNELL UNIVERSITY (US) 2025-08-05 — — US disclosed
US-12268759-B2 Trifunctional constructs with tunable pharmacokinetics useful in imaging and anti-tumor therapies CORNELL UNIVERSITY (US) 2025-04-08 — — US disclosed
US-20240050599-A1 TRIFUNCTIONAL CONSTRUCTS WITH TUNABLE PHARMACOKINETICS USEFUL IN IMAGING AND ANTI-TUMOR THERAPIES CORNELL UNIVERSITY (US) 2024-02-15 — — US disclosed
US-20230285603-A1 TRIFUNCTIONAL CONSTRUCTS WITH TUNABLE PHARMACOKINETICS USEFUL IN IMAGING AND ANTI-TUMOR THERAPIES CORNELL UNIVERSITY (US) 2023-09-14 — — US disclosed
US-20230114130-A1 TRIFUNCTIONAL CONSTRUCTS WITH TUNABLE PHARMACOKINETICS USEFUL IN IMAGING AND ANTI-TUMOR THERAPIES COMELL UNIVERSITY (US) 2023-04-13 — — US disclosed
US-11285227-B2 Trifunctional constructs with tunablepharmacokinetics useful in imaging and anti-tumor therapies CORNELL UNIVERSITY (US) 2022-03-29 — — 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 (6 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-11285227-B2 Trifunctional constructs with tunablepharmacokinetics useful in imaging and anti-tumor therapies MC2R, OGFR, GLS ALB 3175/4885TLR2 4118/4885TLR1 3839/4885
US-20230114130-A1 TRIFUNCTIONAL CONSTRUCTS WITH TUNABLE PHARMACOKINETICS USEFUL IN IMAGING AND ANTI-TUMOR THERAPIES VHL, GLS, KRAS ALB 2124/4885TLR2 4003/4885TLR1 3865/4885
US-20230285603-A1 TRIFUNCTIONAL CONSTRUCTS WITH TUNABLE PHARMACOKINETICS USEFUL IN IMAGING AND ANTI-TUMOR THERAPIES VHL, GLS, GPER1 ALB 2495/4885TLR2 4148/4885TLR1 4326/4885
US-20240050599-A1 TRIFUNCTIONAL CONSTRUCTS WITH TUNABLE PHARMACOKINETICS USEFUL IN IMAGING AND ANTI-TUMOR THERAPIES VHL, GLS, GPER1 ALB 2495/4885TLR2 4148/4885TLR1 4326/4885
US-12377175-B2 Trifunctional constructs with tunable pharmacokinetics useful in imaging and anti-tumor therapies VHL, GLS, GPER1 ALB 2495/4885TLR2 4148/4885TLR1 4326/4885
US-12268759-B2 Trifunctional constructs with tunable pharmacokinetics useful in imaging and anti-tumor therapies VHL, GLS, GPER1 ALB 2495/4885TLR2 4148/4885TLR1 4326/4885

“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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