SCHEMBL28206145

SCHEMBL28206145

NCCCCC(NC(=O)C(Cc1ccc(O)cc1)NC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 3/20 0.64
▸ ITGB3 P05106 1/20 0.60
▸ ITGA2B P08514 1/20 0.60
▸ LNPEP Q9UIQ6 3/20 0.60
▸ ERAP2 Q6P179 2/20 0.60
▸ CTSL P07711 1/20 0.57
▸ PRSS1 P07477 1/20 0.53
▸ PRSS2 P07478 1/20 0.53
▸ PRSS3 P35030 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ CHRNA1 P02708 1/20 0.53
▸ CHRNG P07510 1/20 0.53
▸ CHRNB1 P11230 1/20 0.53
▸ CHRND Q07001 1/20 0.53
▸ GNPAT O15228 1/20 0.52
▸ HPGD P15428 1/20 0.51
▸ FOLH1 Q04609 2/20 0.51
▸ ECE1 P42892 1/20 0.50

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
SCHEMBL18734883 0.91 LNPEP (0.63) GRIA1ITGB3ITGA2BLNPEPERAP2
SCHEMBL29462359 0.87 ERAP2 (0.60) LNPEPERAP2CHRNA1CHRNGCHRNB1
SCHEMBL30184405 0.87 CHRNA1 (0.55) GRIA1LNPEPERAP2CHRNA1CHRNG
SCHEMBL30712028 0.87 ERAP2 (0.60) LNPEPERAP2CHRNA1CHRNGCHRNB1
SCHEMBL31474739 0.87 ERAP2 (0.60) LNPEPERAP2CHRNA1CHRNGCHRNB1
SCHEMBL29577087 0.87 NPY4R (0.59) LNPEPERAP2CHRNA1CHRNGCHRNB1
SCHEMBL31347785 0.87 ERAP2 (0.60) LNPEPERAP2CHRNA1CHRNGCHRNB1
SCHEMBL30591078 0.87 ERAP2 (0.60) LNPEPERAP2CHRNA1CHRNGCHRNB1
SCHEMBL30523241 0.87 ERAP2 (0.60) LNPEPERAP2CHRNA1CHRNGCHRNB1
SCHEMBL29576811 0.87 NPY4R (0.59) LNPEPERAP2CHRNA1CHRNGCHRNB1

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
CN-107677834-A The detection method of TAFIa contents, the kit for detecting TAFIa contents and the application of the two 辽宁迈迪生物科技股份有限公司 2018-02-09 — — CN claimed
CN-107677834-B The application of the detection method of TAFIa content, the kit for detecting TAFIa content and the two 辽宁迈迪生物科技股份有限公司 2019-07-09 — — CN disclosed
CN-107677834-A The detection method of TAFIa contents, the kit for detecting TAFIa contents and the application of the two 辽宁迈迪生物科技股份有限公司 2018-02-09 — — CN disclosed
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