SCHEMBL11399155

SCHEMBL11399155

CCOC(=O)/C=C(/C)NCc1ccncc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.51
GAA P10253 2/20 0.51
KMT2A Q03164 1/20 0.51
MAPT P10636 3/20 0.50
ALDH1A1 P00352 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
PPID Q08752 1/20 0.49
LMNA P02545 3/20 0.49
HTT P42858 2/20 0.48
KDM4E B2RXH2 1/20 0.46
MAPK1 P28482 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
MMP2 P08253 1/20 0.45
CYP3A4 P08684 1/20 0.45
STAT3 P40763 1/20 0.45
MMP13 P45452 1/20 0.45
MAPK14 Q16539 1/20 0.45
RAB9A P51151 1/20 0.44

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
SCHEMBL11399159 1.00 NAMPT (0.51) NAMPTGAAKMT2AMAPTALDH1A1
SCHEMBL11720041 0.85 MAPT (0.48) NAMPTKMT2AMAPTALDH1A1L3MBTL1
SCHEMBL7528187 0.85 MAPT (0.62) NAMPTKMT2AMAPTALDH1A1PPID
SCHEMBL11720022 0.85 MAPT (0.48) NAMPTKMT2AMAPTALDH1A1L3MBTL1
SCHEMBL6734945 0.85 MAPT (0.62) NAMPTKMT2AMAPTALDH1A1PPID
SCHEMBL11726774 0.83 MEN1 (0.50) KMT2AMAPTALDH1A1L3MBTL1LMNA
SCHEMBL11726763 0.83 MEN1 (0.50) KMT2AMAPTALDH1A1L3MBTL1LMNA
SCHEMBL18618468 0.82 ALDH1A1 (0.56) KMT2AALDH1A1L3MBTL1KDM4ESMN1; SMN2
SCHEMBL21124311 0.82 PPID (0.46) NAMPTGAAKMT2AMAPTALDH1A1
SCHEMBL29450231 0.82 ALDH1A1 (0.56) KMT2AALDH1A1L3MBTL1KDM4ESMN1; SMN2

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
US-4273573-A Agents for regulating plant growth using 2-thiazolone-5-carboxylic acid compounds BAYER AKTIENGESELLSCHAFT (DE) 1981-06-16 US disclosed