SCHEMBL11079356

SCHEMBL11079356

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nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CASP1 P29466 9/20 0.38
ALDH1A1 P00352 1/20 0.35
FAAH O00519 1/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
APAF1 O14727 1/20 0.33

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
SCHEMBL10049737 0.84 TDP1 (0.45) TDP1MEN1KMT2ACASP1ALDH1A1
SCHEMBL28287911 0.82 TDP1 (0.40) TDP1MEN1KMT2ACASP1ALDH1A1
SCHEMBL16093518 0.81 MEN1 (0.42) TDP1MEN1KMT2ACASP1ALDH1A1
SCHEMBL18159716 0.81 TDP1 (0.39) TDP1MEN1KMT2ACASP1ALDH1A1
SCHEMBL27577559 0.80 CASP1 (0.44) TDP1CASP1
SCHEMBL27577561 0.80 CASP1 (0.44) TDP1CASP1
SCHEMBL8260665 0.80 FAAH (0.38) TDP1MEN1KMT2ACASP1FAAH
SCHEMBL20663472 0.80 FAAH (0.38) TDP1MEN1KMT2ACASP1FAAH
SCHEMBL17324271 0.79 GFPT1 (0.45) MEN1KMT2ACASP1MAPTCACNA1B
SCHEMBL9313394 0.79 TDP1 (0.38) TDP1MEN1KMT2ACASP1ALDH1A1

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
EP-0125208-A1 Amino-lower-alkyl-penem derivatives, process for their preparation, pharmaceutical compositions containing them and their use CIBA-GEIGY AG (CH) 1984-11-14 EP disclosed