SCHEMBL11243772

SCHEMBL11243772

CCCCOC(=O)c1ccc(OC)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.62
MEN1 O00255 3/20 0.62
HDAC3 O15379 1/20 0.59
HDAC1 Q13547 1/20 0.59
HDAC2 Q92769 1/20 0.59
TSHR P16473 3/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
TDP1 Q9NUW8 1/20 0.57
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
USP2 O75604 2/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
TP53 P04637 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 2/20 0.50
THRA P10827 1/20 0.50

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
SCHEMBL11241762 0.91 KMT2A (0.68) KMT2AMEN1L3MBTL1NPC1RAB9A
SCHEMBL18489560 0.88 TSHR (0.65) KMT2AMEN1HDAC3HDAC1HDAC2
SCHEMBL28233208 0.87 TSHR (0.56) KMT2AMEN1HDAC3HDAC1HDAC2
SCHEMBL17502700 0.87 KMT2A (0.56) KMT2AMEN1TSHRL3MBTL1TDP1
SCHEMBL7488349 0.86 KMT2A (0.67) KMT2AMEN1HDAC3HDAC1HDAC2
SCHEMBL17502664 0.85 KDM4E (0.59) KMT2AMEN1TSHRL3MBTL1TDP1
SCHEMBL12392710 0.85 CYP1A2 (0.60) KMT2ATSHRL3MBTL1TDP1NPC1
SCHEMBL31198163 0.85 L3MBTL1 (0.60) TSHRL3MBTL1TDP1NPC1RAB9A
SCHEMBL7285937 0.85 KMT2A (0.62) KMT2AMEN1L3MBTL1NPC1RAB9A
SCHEMBL7285948 0.85 KMT2A (0.62) KMT2AMEN1L3MBTL1NPC1RAB9A

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-4342875-A STABILIZERS FOR OLEFIN POLYMERS CINCINNATI-MILACRON, INC. (US) 1982-08-03 US disclosed