SCHEMBL21399752

SCHEMBL21399752

COC1C(c2ccccc2)C(c2ccccc2)C(C)C(c2ccccc2)C1c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
NR3C1 P04150 2/20 0.35
MAOA P21397 6/20 0.35
MAOB P27338 5/20 0.34
KDM1A O60341 4/20 0.33
GAA P10253 1/20 0.33
CA2 P00918 2/20 0.32
CA4 P22748 1/20 0.32

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
SCHEMBL30504112 0.83 MAOA (0.41) POLBMAOAMAOBKDM1A
SCHEMBL21399754 0.81 POLB (0.38) POLBMAOAMAOBKDM1ACA4
SCHEMBL30312236 0.78 MAOA (0.41) POLBNR3C1MAOAMAOBKDM1A
SCHEMBL30312066 0.78 MAOA (0.41) POLBNR3C1MAOAMAOBKDM1A
SCHEMBL30311870 0.78 MAOA (0.41) POLBMAOAMAOBKDM1A
SCHEMBL8435497 0.73 MAOA (0.41) POLBMAOAMAOBKDM1A
SCHEMBL21208288 0.71 MAOA (0.35) POLBMAOAMAOB
SCHEMBL25332884 0.70 MAOA (0.34) POLBMAOAMAOB
SCHEMBL19366234 0.68 SLC6A2 (0.39) POLBMAOAMAOBKDM1A
SCHEMBL26554075 0.67 TSHR (0.37)

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
WO-2019180230-A1 TETRAPHENYLPHENOXY TUNGSTEN OXO ALKYLIDENE COMPLEXES, METHODS OF MAKING SAME AND USE THEREOF XIMO AG (CH) 2019-09-26 WO disclosed