SCHEMBL15548567

SCHEMBL15548567

CCCCCCCCC(C)C(=O)Oc1ccc(OC(=O)CCC)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 1/20 0.48
CTNNB1 P35222 1/20 0.48
KMT2A Q03164 5/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 1/20 0.40
ALOX15 P16050 2/20 0.40
CA1 P00915 2/20 0.40
HTR1A P08908 1/20 0.39
HTR1B P28222 1/20 0.39

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
SCHEMBL15547223 0.94 KMT2A (0.53) KMT2ASMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL15548397 0.94 KMT2A (0.53) KMT2ASMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL15546907 0.85 ELANE (0.46) LMNAMAPTPRSS1PRSS2PRSS3
SCHEMBL6913900 0.85 NR5A1 (0.50) SMN1; SMN2ALDH1A1LMNAHSD17B10PRSS1
SCHEMBL6938745 0.85 NR5A1 (0.50) SMN1; SMN2ALDH1A1LMNAHSD17B10PRSS1
SCHEMBL15548402 0.84 KMT2A (0.49) KMT2AALDH1A1LMNAMAPTPRSS1
SCHEMBL15548124 0.84 KMT2A (0.49) KMT2AALDH1A1LMNAMAPTPRSS1
SCHEMBL15548266 0.84 KMT2A (0.49) KMT2AALDH1A1LMNAMAPTPRSS1
SCHEMBL15548239 0.84 KMT2A (0.54) KMT2ASMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL28063048 0.84 PPARA (0.45) KMT2ALMNAMAPTPRSS1PRSS2

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-2872538-A1 ZIEGLER-NATTA CATALYST SYSTEMS COMPRISING A 1,2-PHENYLENEDIOATE AS INTERNAL DONOR AND PROCESS FOR PREPARING THE SAME Indian Oil Corporation Ltd (IN) 2015-05-20 EP claimed
WO-2014013401-A1 ZIEGLER-NATTA CATALYST SYSTEMS COMPRISING A 1,2-PHENYLENEDIOATE AS INTERNAL DONOR AND PROCESS FOR PREPARING THE SAME INDIAN OIL CORPORATION LIMITED (IN) 2014-01-23 WO claimed