SCHEMBL29024434

SCHEMBL29024434

O=C(O)[C@H](Cc1ccccc1)NN1C(=O)C=CC1=O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 2/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.48
▸ FPR2 P25090 2/20 0.47
▸ NAALAD2 Q9Y3Q0 2/20 0.47
▸ CYP1A2 P05177 1/20 0.46
▸ MMP2 P08253 4/20 0.46
▸ MMP9 P14780 3/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ADAMTS4 O75173 1/20 0.46
▸ FOLH1 Q04609 1/20 0.45
▸ CPA3 P15088 1/20 0.45

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
SCHEMBL7265100 0.86 ALDH1A1 (0.56) MMENPSR1FPR2NAALAD2MMP2
SCHEMBL7272751 0.86 ALDH1A1 (0.56) MMENPSR1FPR2NAALAD2MMP2
SCHEMBL20153838 0.85 MMP1 (0.49) MMP2MMP9
SCHEMBL27349758 0.85 ATM (0.53) L3MBTL1
SCHEMBL29358407 0.81 KDM6B (0.51) MMECYP1A2FOLH1
SCHEMBL25386615 0.80 POLB (0.56) MMENPSR1NAALAD2CYP1A2MMP2
SCHEMBL29631981 0.78 KDM4E (0.42) MMEFOLH1CPA3
SCHEMBL31549503 0.78 TGFBR1 (0.37) MME
SCHEMBL29024583 0.76 MME (0.38) MME
SCHEMBL7406797 0.75 ALDH1A1 (0.54) MMENPSR1NAALAD2CYP1A2MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116323634-A Modification of protein oligomers forming nanopores 牛津纳米孔科技公开有限公司 2023-06-23 — — CN disclosed
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