SCHEMBL11240645

SCHEMBL11240645

CCCCCCCCNC(=O)c1ccc(OC)c(OC)c1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.76
SMPD1 P17405 5/20 0.73
MGLL Q99685 1/20 0.67
HDAC3 O15379 1/20 0.67
HDAC2 Q92769 1/20 0.67
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
CNR2 P34972 1/20 0.62
ROCK2 O75116 1/20 0.62
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
TP53 P04637 1/20 0.61

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
SCHEMBL11246226 1.00 POLB (0.76) POLBSMPD1MGLLHDAC3HDAC2
SCHEMBL3880413 1.00 POLB (0.76) POLBSMPD1MGLLHDAC3HDAC2
SCHEMBL931440 0.99 POLB (0.73) POLBSMPD1MGLLHDAC3HDAC2
SCHEMBL6356934 0.94 HDAC3 (0.74) POLBSMPD1MGLLHDAC3HDAC2
SCHEMBL11761148 0.94 POLB (0.84) POLBSMPD1HDAC3HDAC2MEN1
Hydrochloric Acid SCHEMBL9639590 0.93 HDAC3 (0.72) POLBSMPD1MGLLHDAC3HDAC2
SCHEMBL2800438 0.89 SMPD1 (0.62) POLBSMPD1MGLLMEN1KMT2A
SCHEMBL598032 0.89 SMPD1 (0.62) POLBSMPD1MGLLMEN1KMT2A
SCHEMBL10958244 0.89 SMPD1 (0.62) POLBSMPD1MGLLMEN1KMT2A
SCHEMBL28907470 0.89 POLB (0.76) POLBSMPD1HDAC3HDAC2MEN1

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