SCHEMBL7581350

SCHEMBL7581350

CC(C)(C)OC(=O)N1CCN(c2cc(Br)c(Cl)c(Br)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
LMNA P02545 2/20 0.53
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.49
PDK2 Q15119 1/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GPR119 Q8TDV5 4/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
SUV39H2 Q9H5I1 1/20 0.47
TSHR P16473 1/20 0.46
NAMPT P43490 1/20 0.46
KCNH2 Q12809 1/20 0.46
POLB P06746 1/20 0.45
CYP2C19 P33261 1/20 0.45
MAPK8 P45983 1/20 0.44

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
SCHEMBL7585050 0.90 MAPT (0.47) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL23784871 0.87 MAPT (0.57) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL7585009 0.87 MAPT (0.45) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL30930919 0.86 MAPT (0.51) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL19001559 0.86 MAPT (0.51) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL7582943 0.86 LMNA (0.51) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL805892 0.86 MAPT (0.53) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL17884463 0.86 MAPT (0.53) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL24847031 0.85 MAPT (0.56) MAPTLMNAALDH1A1SMN1; SMN2PDK2
SCHEMBL7585738 0.85 MAPT (0.47) MAPTLMNAALDH1A1SMN1; SMN2PDK2

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-0675118-B1 Biphenylderivatives, process for their preparation and their use as medicaments EISAI CO LTD (JP) 2002-10-09 EP disclosed
US-6281214-B1 USEFUL FOR TREATING AND AMELIORATING MENTAL DISORDERS EISAI CO., LTD (JP) 2001-08-28 US disclosed
US-5849912-A Biphenyl derivatives EISAI CO., LTD. (JP) 1998-12-15 US disclosed
EP-0675118-A2 Biphenylderivatives, process for their preparation and their use as medicaments Eisai Co., Ltd. (JP) 1995-10-04 EP disclosed