SCHEMBL8498461

SCHEMBL8498461

FCCNCc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.67
EPHX2 P34913 1/20 0.67
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
DRD4 P21917 2/20 0.51
OPRM1 P35372 1/20 0.51
OPRD1 P41143 1/20 0.51
OPRK1 P41145 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
BCHE P06276 4/20 0.49
RECQL P46063 1/20 0.48
MAOA P21397 1/20 0.46

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
SCHEMBL3025568 0.86 LTA4H (0.62) LTA4HEPHX2KDM4EALDH1A1HTT
SCHEMBL8497858 0.85 KDM4E (0.67) LTA4HEPHX2KDM4EALDH1A1HTT
SCHEMBL7756966 0.83 KDM4E (0.70) LTA4HEPHX2KDM4EALDH1A1HTT
SCHEMBL1847756 0.82 MEN1 (0.73) KDM4EALDH1A1DRD4MEN1KMT2A
SCHEMBL8445838 0.82 LTA4H (0.62) LTA4HEPHX2KDM4EALDH1A1HTT
SCHEMBL9081140 0.82 LTA4H (0.82) LTA4HEPHX2KDM4EALDH1A1HTT
SCHEMBL8499156 0.82 LTA4H (0.82) LTA4HEPHX2KDM4EALDH1A1HTT
SCHEMBL8826307 0.82 LTA4H (0.62) LTA4HEPHX2KDM4EALDH1A1HTT
Hydrochloric Acid SCHEMBL9079843 0.81 KDM4E (0.68) LTA4HEPHX2KDM4EALDH1A1HTT
Hydrochloric Acid SCHEMBL8492706 0.81 LTA4H (0.60) LTA4HEPHX2KDM4EALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0677039-B1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE ABBOTT LAB (US) 1999-03-10 EP disclosed
US-5783593-A FUNGICIDE; ANTICHOLESTEROL AGENT ABBOTT LABORATORIES (US) 1998-07-21 US disclosed
WO-1996034850-A1 CYCLOBUTANE DERIVATIVES AND THEIR USE AS INHIBITORS OF PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1996-11-07 WO disclosed
EP-0677039-A1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE Abbott Laboratories (US) 1995-10-18 EP disclosed
WO-1995012572-A1 CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1995-05-11 WO disclosed