SCHEMBL9847229

SCHEMBL9847229

CCCCOC(=O)CCCCCN1C(=O)CCC1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.53
MAPT P10636 3/20 0.53
RECQL P46063 2/20 0.53
DGKA P23743 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
ALDH1A1 P00352 2/20 0.48
KMT2A Q03164 1/20 0.48
FAAH O00519 1/20 0.46
MGLL Q99685 1/20 0.46
DNM1 Q05193 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
KDM4E B2RXH2 1/20 0.43
PRKCA P17252 3/20 0.41
PAM P19021 2/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL18789580 0.86 DNM1 (0.48) MAPK1MAPTRECQLDGKASMN1; SMN2
SCHEMBL10432975 0.85 MGLL (0.51) DGKASMN1; SMN2HPGDHTTALDH1A1
SCHEMBL7466378 0.84 SMN1; SMN2 (0.50) MAPTSMN1; SMN2HPGDHTTALDH1A1
SCHEMBL5165318 0.82 PTGS1 (0.60) MAPK1MAPTRECQLDGKASMN1; SMN2
SCHEMBL5165324 0.82 PTGS1 (0.60) MAPK1MAPTRECQLDGKASMN1; SMN2
SCHEMBL19223897 0.81 SMN1; SMN2 (0.50) MAPTSMN1; SMN2HPGDHTTALDH1A1
SCHEMBL26032639 0.81 SMN1; SMN2 (0.53) MAPK1MAPTRECQLSMN1; SMN2HPGD
SCHEMBL15693392 0.80 KMT2A (0.51) MAPK1MAPTRECQLSMN1; SMN2ALDH1A1
SCHEMBL10432974 0.79 SMN1; SMN2 (0.54) MAPTSMN1; SMN2HPGDHTTALDH1A1
SCHEMBL495445 0.79 DGKA (0.83) MAPTDGKAALDH1A1KMT2ADNM1

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
EP-0414631-A1 Auxiliary agent mixture and its use in dyeing polyester fibre materials CIBA-GEIGY AG (CH) 1991-02-27 EP disclosed
EP-0033715-A1 Auxiliary and its use in the dyeing or optical brightening of polyester fibre materials CIBA-GEIGY AG (CH) 1981-08-12 EP disclosed