SCHEMBL30514849

SCHEMBL30514849

CC(C)C[C@@H]1NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc(O)cc2)NC1=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KLK5 Q9Y337 2/20 0.53
▸ ALB P02768 1/20 0.53
▸ HDAC4 P56524 2/20 0.53
▸ FLT1 P17948 1/20 0.52
▸ PSMB11 A5LHX3 1/20 0.51
▸ PSMA7 O14818 1/20 0.51
▸ PSMB1 P20618 1/20 0.51
▸ PSMA1 P25786 1/20 0.51
▸ PSMA2 P25787 1/20 0.51
▸ PSMA3 P25788 1/20 0.51
▸ PSMA4 P25789 1/20 0.51
▸ PSMB8 P28062 1/20 0.51
▸ PSMB9 P28065 1/20 0.51
▸ PSMA5 P28066 1/20 0.51
▸ PSMB4 P28070 1/20 0.51
▸ PSMB6 P28072 1/20 0.51
▸ PSMB5 P28074 1/20 0.51
▸ PSMB10 P40306 1/20 0.51
▸ PSMB3 P49720 1/20 0.51
▸ PSMB2 P49721 1/20 0.51

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
Tyrocidine A SCHEMBL12131172 0.91 HDAC4 (0.55) KLK5ALBHDAC4FLT1CIB1
Tyrocidine A SCHEMBL16418974 0.91 HDAC4 (0.55) KLK5ALBHDAC4FLT1CIB1
Tyrocidine A SCHEMBL14399288 0.91 HDAC4 (0.55) KLK5ALBHDAC4FLT1CIB1
Tyrocidine A1 SCHEMBL29489412 0.90 HDAC4 (0.56) KLK5ALBHDAC4FLT1CIB1
Tyrocidine A1 SCHEMBL31412201 0.90 HDAC4 (0.56) KLK5ALBHDAC4FLT1CIB1
SCHEMBL29368119 0.89 NTSR1 (0.57) HDAC4CIB1TERF2
SCHEMBL29367084 0.89 NTSR1 (0.57) HDAC4CIB1TERF2
SCHEMBL17133082 0.87 FLT1 (0.57) KLK5HDAC4FLT1CIB1GRB2
Gratisin SCHEMBL29885076 0.87 HDAC4 (0.58) HDAC4FLT1
SCHEMBL31412206 0.86 TFPI (0.50) KLK5ALBHDAC4FLT1CIB1

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
CN-113873924-B Method for manufacturing cookware comprising thermochromic composite coating and cookware manufactured by the method 株式会社 厨福莱茵 2024-12-31 — — CN disclosed
US-11723897-B2 Fatty acids as anti-inflammatory agents University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2023-08-15 — — 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-11723897-B2 Fatty acids as anti-inflammatory agents ALOX15B, FFAR1, ALOX12 KLK5 4094/4885ALB 1390/4885HDAC4 969/4885

“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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