SCHEMBL28875871

SCHEMBL28875871

C=CC(=O)NNC(CCC(N)=O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
ALOX15 P16050 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
CA2 P00918 5/20 0.37
CA1 P00915 4/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
FOLH1 Q04609 2/20 0.34
RIMKLA Q8IXN7 1/20 0.34
NAALAD2 Q9Y3Q0 1/20 0.34
BMP1 P13497 1/20 0.33
FNTA P49354 2/20 0.31
FNTB P49356 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GNPAT O15228 1/20 0.31

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
SCHEMBL28875868 1.00 KMT2A (0.40) KMT2AALOX15BLMPMP22MMP2
SCHEMBL5574761 0.86 FOLH1 (0.48) KMT2ABLMFOLH1RIMKLANAALAD2
SCHEMBL5574766 0.86 FOLH1 (0.48) KMT2ABLMFOLH1RIMKLANAALAD2
SCHEMBL28875835 0.83 MEN1 (0.39) KMT2ACA2CA1ALDH1A1TSHR
SCHEMBL28875836 0.83 MEN1 (0.39) KMT2ACA2CA1ALDH1A1TSHR
SCHEMBL8185224 0.83 KMT2A (0.47) KMT2AALOX15BLMPMP22MMP2
SCHEMBL8185221 0.83 KMT2A (0.47) KMT2AALOX15BLMPMP22MMP2
SCHEMBL21518472 0.80 KMT2A (0.54) KMT2AALOX15BLMPMP22MMP2
SCHEMBL27411827 0.77 KMT2A (0.44) KMT2AALOX15BLMPMP22MMP2
SCHEMBL31139984 0.77 TGFBR1 (0.40) ALDH1A1TSHRMAPK1TDP1

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-108473743-B Resin composition and multilayer structure using same 三菱化学株式会社 2024-03-12 CN disclosed
CN-115135307-A Carrier for cell delivery 株式会社ITO 2022-09-30 CN disclosed