SCHEMBL8934131

SCHEMBL8934131

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nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.51
TGFBR1 P36897 3/20 0.49
ACE P12821 1/20 0.41
ALDH1A1 P00352 1/20 0.39
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
NFKB1 P19838 1/20 0.36
PTGS2 P35354 1/20 0.36
THPO P40225 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 1/20 0.35
FOLH1 Q04609 2/20 0.35
NAALAD2 Q9Y3Q0 2/20 0.35
CASP3 P42574 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
ECE1 P42892 1/20 0.34

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
SCHEMBL8934138 1.00 MME (0.51) MMETGFBR1ACEALDH1A1KDM4E
SCHEMBL19119032 0.80 ECE1 (0.37) MMETGFBR1ACEALDH1A1KDM4E
SCHEMBL19107072 0.79 ECE1 (0.36) MMEACEALDH1A1KDM4EMAPT
SCHEMBL5969049 0.77 TGFBR1 (0.47) MMETGFBR1ACEALDH1A1KDM4E
SCHEMBL5969046 0.77 TGFBR1 (0.47) MMETGFBR1ACEALDH1A1KDM4E
SCHEMBL9650023 0.77 MME (0.58) MMETGFBR1ACEALDH1A1KDM4E
SCHEMBL13380098 0.77 MME (0.58) MMETGFBR1ACEALDH1A1KDM4E
SCHEMBL14163011 0.77 MME (0.58) MMETGFBR1ACEALDH1A1KDM4E
SCHEMBL16314051 0.75 MME (0.56) MMETGFBR1ACEALDH1A1THRB
SCHEMBL12449198 0.74 TSHR (0.46) ALDH1A1MAPTBLMSMN1; SMN2TSHR

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
WO-1996032372-A1 SERINE DERIVATIVES AND USE THEREOF IN COSMETICS SOCHINAZ S.A. (FR) 1996-10-17 WO disclosed