SCHEMBL9503303

SCHEMBL9503303

O=C(CCC(=O)N(CCO)CCO)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.55
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 5/20 0.50
TDP1 Q9NUW8 3/20 0.50
MAPT P10636 3/20 0.50
LMNA P02545 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GAA P10253 1/20 0.50
CYP2C19 P33261 1/20 0.50
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
MAPK1 P28482 3/20 0.47
CTNNB1 P35222 2/20 0.47
WNT3A P56704 2/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL30121738 0.78 NR4A2 (0.85) NR4A2KMT2AALDH1A1TDP1MAPT
SCHEMBL719034 0.78 NR4A2 (0.85) NR4A2KMT2AALDH1A1TDP1MAPT
SCHEMBL79657 0.76 TDP1 (0.67) NR4A2KMT2AALDH1A1TDP1MAPT
SCHEMBL6531523 0.76 ALDH1A1 (0.52) NR4A2KMT2AALDH1A1TDP1MAPT
SCHEMBL940512 0.76 KMT2A (0.63) NR4A2KMT2AALDH1A1TDP1MAPT
SCHEMBL1232870 0.76 ALDH1A1 (0.41) ALDH1A1MAPTLMNAGAAPOLB
SCHEMBL11587892 0.75 L3MBTL1 (0.60) NR4A2KMT2AALDH1A1TDP1MAPT
SCHEMBL154607 0.75 HPGD (0.53) KMT2AALDH1A1MAPTL3MBTL1GAA
SCHEMBL27719889 0.74 TDP1 (0.64) NR4A2KMT2AALDH1A1TDP1MAPT
SCHEMBL13562561 0.74 KMT2A (0.56) NR4A2KMT2AALDH1A1TDP1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300325-B1 COMPOSITIONS FOR PROMOTING GROWTH OF ANIMALS COMETEC S.r.l. (IT) 1993-06-16 EP disclosed
US-4950669-A SIDE EFFECT REDUCTION COMETEC S.R.L. (IT) 1990-08-21 US disclosed
EP-0300325-A2 Compositions for promoting growth of animals COMETEC S.r.l. (IT) 1989-01-25 EP disclosed