SCHEMBL7544178

SCHEMBL7544178

Cc1ccc(OCCCCCCC(C)C)cn1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.47
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 1/20 0.42
HTR1A P08908 1/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
CHRNB2 P17787 4/20 0.40
CHRNA4 P43681 4/20 0.40
CHRNB1 P11230 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNB3 Q05901 1/20 0.38
GRM5 P41594 1/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37

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
SCHEMBL1563418 0.88 TDP1 (0.55) KMT2AMAPTTDP1CHRNB2CHRNA4
SCHEMBL7543027 0.86 TDP1 (0.42) RARBKMT2AMAPTTDP1CHRNB2
SCHEMBL7543086 0.86 TDP1 (0.42) RARBKMT2AMAPTTDP1CHRNB2
SCHEMBL7546685 0.81 MAPT (0.59) KMT2AMAPT
SCHEMBL7536680 0.81 MAPT (0.59) KMT2AMAPT
SCHEMBL7544666 0.81 MAPT (0.59) KMT2AMAPT
SCHEMBL7536641 0.81 MAPT (0.59) KMT2AMAPT
SCHEMBL18256805 0.81 MAPT (0.59) KMT2AMAPT
SCHEMBL7544659 0.81 MAPT (0.59) KMT2AMAPT
SCHEMBL21156450 0.81 RARB (0.51) RARBKMT2AMAPTTDP1GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1204320-A2 NOVEL JUVENILE HORMONE ANALOGUES AND THEIR USE AS ANTIFOULING AGENTS Bioparken AS (NO) 2002-05-15 EP claimed
WO-2001006853-A2 NOVEL JUVENILE HORMONE ANALOGUES AND THEIR USE AS ANTIFOULING AGENTS BIOPARKEN AS (NO) 2001-02-01 WO claimed
EP-1204320-A2 NOVEL JUVENILE HORMONE ANALOGUES AND THEIR USE AS ANTIFOULING AGENTS Bioparken AS (NO) 2002-05-15 EP disclosed
EP-1204413-A2 CONTROL OF CRUSTACEAN INFESTATION OF AQUATIC ANIMALS Bioparken AS (NO) 2002-05-15 EP disclosed
WO-2001006853-A2 NOVEL JUVENILE HORMONE ANALOGUES AND THEIR USE AS ANTIFOULING AGENTS BIOPARKEN AS (NO) 2001-02-01 WO disclosed
WO-2001007047-A2 CONTROL OF CRUSTACEAN INFESTATION OF AQUATIC ANIMALS BIOPARKEN AS (NO) 2001-02-01 WO disclosed