SCHEMBL8030232

SCHEMBL8030232

CC(C)(C)c1cc(CCC(=O)NCCCCCCO)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
GAA P10253 2/20 0.53
PYGL P06737 1/20 0.52
TRPV1 Q8NER1 3/20 0.48
MEN1 O00255 2/20 0.48
HSD17B10 Q99714 2/20 0.48
MAPT P10636 2/20 0.48
GPR119 Q8TDV5 1/20 0.45
HPGD P15428 2/20 0.44
POLB P06746 2/20 0.44
MAOA P21397 1/20 0.44
ACHE P22303 1/20 0.44
MAOB P27338 1/20 0.44
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL7941189 0.99 KMT2A (0.54) KMT2AGAAPYGLTRPV1MEN1
SCHEMBL7942336 0.95 KMT2A (0.55) KMT2AGAAPYGLTRPV1MEN1
SCHEMBL924084 0.95 KMT2A (0.58) KMT2AGAAPYGLTRPV1MEN1
SCHEMBL9677227 0.91 KMT2A (0.59) KMT2AGAAPYGLTRPV1MEN1
SCHEMBL22540654 0.90 GAA (0.67) KMT2AGAAPYGLTRPV1MEN1
SCHEMBL7944852 0.90 KMT2A (0.58) KMT2AGAAPYGLTRPV1MEN1
SCHEMBL8606711 0.86 KMT2A (0.54) KMT2AGAAPYGLTRPV1MEN1
SCHEMBL7943176 0.86 GAA (0.71) KMT2AGAAPYGLMEN1HPGD
SCHEMBL7941028 0.85 GAA (0.73) KMT2AGAAPYGLMEN1HPGD
SCHEMBL8605886 0.84 GAA (0.56) KMT2AGAAPYGLTRPV1MEN1

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
US-6075159-A USE AS A STABILIZER FOR AN ORGANIC MATERIAL SUCH AS THERMOPLASTIC RESINS, THERMOSETTING RESINS, NATURAL OR SYNTHETIC RUBBERS, MINERAL OILS, LUBRICATING OILS, ADHESIVES AND PAINTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-06-13 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed