SCHEMBL8613596

SCHEMBL8613596

CC(=O)OC=Cc1ccccc1.ClCC=Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.46
GLA P06280 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAOB P27338 1/20 0.40
IDO1 P14902 2/20 0.39
HDAC3 O15379 1/20 0.38
TNKS O95271 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
PLIN1 O60240 1/20 0.38

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
SCHEMBL58005 0.87 GLA (0.55) PAMGLATDP1MAOBHDAC3
SCHEMBL2985370 0.87 GLA (0.55) PAMGLATDP1MAOBHDAC3
SCHEMBL19923136 0.87 GLA (0.55) PAMGLATDP1MAOBHDAC3
SCHEMBL28197253 0.85 GLA (0.53) PAMGLATDP1MAOBHDAC3
Ammonia Solution, Strong SCHEMBL28298189 0.85 GLA (0.53) PAMGLATDP1MAOBHDAC3
SCHEMBL5197712 0.85 GLA (0.53) PAMGLATDP1MAOBHDAC3
Methane SCHEMBL27458308 0.85 GLA (0.53) PAMGLATDP1MAOBHDAC3
SCHEMBL5197700 0.85 GLA (0.53) PAMGLATDP1MAOBHDAC3
Water SCHEMBL27837588 0.85 GLA (0.53) PAMGLATDP1MAOBHDAC3
SCHEMBL30740033 0.84 PAM (0.69) PAMGLATDP1MAOBIDO1

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-5728501-A POLYMERS OF ETHYLENICALLY UNSATURATED MONMERS SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-17 US disclosed