SCHEMBL30150290

SCHEMBL30150290

NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 2/20 0.53
▸ ECE1 P42892 1/20 0.51
▸ PTPN1 P18031 2/20 0.50
▸ MDM2 Q00987 4/20 0.49
▸ ITGB3 P05106 4/20 0.48
▸ ITGA2B P08514 4/20 0.48
▸ CTSL P07711 1/20 0.48

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
SCHEMBL30193301 1.00 TLR2 (0.53) TLR2ECE1PTPN1MDM2ITGB3
SCHEMBL20758974 0.99 TLR2 (0.55) TLR2ECE1PTPN1MDM2
SCHEMBL20759079 0.99 TLR2 (0.55) TLR2ECE1PTPN1MDM2
SCHEMBL20758846 0.99 TLR2 (0.55) TLR2ECE1PTPN1MDM2
SCHEMBL31566096 0.99 TLR2 (0.55) TLR2ECE1PTPN1MDM2
SCHEMBL30598967 0.96 TLR2 (0.55) TLR2ECE1PTPN1ITGB3ITGA2B
SCHEMBL30099539 0.95 PTPN1 (0.57) TLR2ECE1PTPN1
SCHEMBL31138058 0.94 PTPN1 (0.57) TLR2PTPN1MDM2
SCHEMBL31212512 0.93 TLR2 (0.59) TLR2PTPN1MDM2
SCHEMBL31389333 0.92 TLR2 (0.51) TLR2ECE1PTPN1CTSL

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-115558464-B Application of polypeptide derivative, underwater adhesive, adhesive coating and preparation method of adhesive coating 天津大学浙江研究院 2024-08-23 — — CN disclosed
CN-115558464-A Application of polypeptide derivative, underwater adhesive, adhesive coating and preparation method thereof 天津大学浙江研究院 2023-01-03 — — CN disclosed
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