SCHEMBL29471808

SCHEMBL29471808

C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRB2 P62993 1/20 0.48
▸ CAPN1 P07384 4/20 0.46
▸ CTSD P07339 1/20 0.43
▸ BACE1 P56817 1/20 0.43
▸ CALCRL Q16602 1/20 0.42
▸ RAMP3 O60896 3/20 0.41
▸ CALCR P30988 3/20 0.41
▸ F2 P00734 1/20 0.41
▸ CXCL8 P10145 8/20 0.41
▸ BDKRB2 P30411 1/20 0.41
▸ CTSB P07858 1/20 0.40

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
SCHEMBL31218906 0.90 GRB2 (0.51) GRB2CAPN1RAMP3CALCRBDKRB2
SCHEMBL29546551 0.84 GRB2 (0.48) GRB2CAPN1CTSDBACE1CALCRL
SCHEMBL29547288 0.84 GRB2 (0.48) GRB2CAPN1CTSDBACE1CALCRL
SCHEMBL8054556 0.84 GRB2 (0.47) GRB2CAPN1CALCRL
SCHEMBL8054560 0.84 GRB2 (0.47) GRB2CAPN1CALCRL
SCHEMBL31064871 0.84 CAPN1 (0.48) GRB2CAPN1CALCRLCTSB
SCHEMBL31696320 0.83 CTSD (0.45) GRB2CAPN1CTSDBACE1F2
SCHEMBL30444471 0.83 CTSD (0.46) GRB2CTSDBACE1CALCRLF2
SCHEMBL31126281 0.83 CALCRL (0.43) CAPN1CALCRLF2CXCL8
SCHEMBL30443935 0.83 CALCRL (0.46) GRB2CTSDBACE1CALCRLF2

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-12551565-B2 CD44 targeted multi-arm conjugate BRIGHTGENE BIO-MEDICAL TECHNOLOGY CO., LTD. (CN) 2026-02-17 — — US disclosed
EP-3928797-B1 CD44 TARGETED MULTI-ARM CONJUGATE BRIGHTGENE BIO MEDICAL TECH CO LTD (CN) 2024-10-09 — — EP disclosed
US-20220096644-A1 CD44 TARGETED MULTI-ARM CONJUGATE BRIGHTGENE BIO-MEDICAL TECHNOLOGY CO., LTD. (CN) 2022-03-31 — — 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-12551565-B2 CD44 targeted multi-arm conjugate CD44, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MUC1 GRB2 3175/4885CAPN1 1266/4885CTSD 4077/4885
US-20220096644-A1 CD44 TARGETED MULTI-ARM CONJUGATE CD44, BCL6, SIGLEC7 GRB2 3145/4885CAPN1 2481/4885CTSD 3154/4885

“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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