SCHEMBL8967653

SCHEMBL8967653

OCC1(F)CC1c1ccc(Cl)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 15/20 0.39
SLC6A4 P31645 15/20 0.39
SLC6A3 Q01959 11/20 0.39
KCNH2 Q12809 2/20 0.38
NPSR1 Q6W5P4 1/20 0.36
CYP2D6 P10635 1/20 0.34

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
SCHEMBL24738025 0.79 KDM1A (0.50) SLC6A2SLC6A4SLC6A3
SCHEMBL9430622 0.77 KDM1A (0.39) KCNH2
Methyl Alcohol SCHEMBL9580463 0.76 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3KCNH2NPSR1
SCHEMBL3829782 0.72 SLC6A3 (0.41) SLC6A2SLC6A4SLC6A3KCNH2NPSR1
SCHEMBL21586875 0.72 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3KCNH2NPSR1
SCHEMBL9839154 0.71 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3KCNH2NPSR1
SCHEMBL28190200 0.67 NPSR1 (0.43) SLC6A2SLC6A4SLC6A3NPSR1
SCHEMBL8461900 0.66 TSHR (0.46) SLC6A2SLC6A4SLC6A3NPSR1
SCHEMBL21728894 0.65 CYP3A4 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL9430556 0.64 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3KCNH2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0553081-B1 PESTICIDES ROUSSEL UCLAF (FR) 1996-02-28 EP disclosed
US-5326755-A Contain cyclopropane ring ROUSSEL UCLAF 1994-07-05 US disclosed
EP-0553081-A1 PESTICIDES. ROUSSEL UCLAF (FR) 1993-08-04 EP disclosed
WO-1991016301-A1 PESTICIDES THE WELLCOME FOUNDATION LIMITED (GB) 1991-10-31 WO disclosed