SCHEMBL11599192

SCHEMBL11599192

COc1ccc(C(O)(c2ccc(Cl)cc2Cl)C(O)(c2ccc(OC)cc2F)c2ccc(Cl)cc2Cl)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
RAB9A P51151 2/20 0.41
CYP19A1 P11511 1/20 0.41
AMY1A P0DUB6 1/20 0.40
CYP3A4 P08684 3/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KIF11 P52732 3/20 0.39
NPC1 O15118 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.38
POLB P06746 1/20 0.38
CYP3A5 P20815 2/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TAS1R2 Q8TE23 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
SCHEMBL4463092 0.76 KIF11 (0.44) MAPTRAB9AAMY1ACYP3A4KIF11
SCHEMBL531512 0.74 KIF11 (0.47) KIF11
SCHEMBL11525373 0.73 CYP3A4 (0.40) MAPTRAB9ACYP19A1CYP3A4TSHR
SCHEMBL11520963 0.72 KIF11 (0.40) TSHRKIF11
SCHEMBL14016070 0.70 KIF11 (0.43) MAPTAMY1ATSHRKIF11KMT2A
SCHEMBL10686133 0.70 KIF11 (0.49) AMY1AMAPK1KIF11SMN1; SMN2KMT2A
SCHEMBL22544183 0.70 CYP3A4 (0.45) CYP19A1CYP3A4TSHRMAPK1TDP1
SCHEMBL1506600 0.70 KIF11 (0.49) AMY1AMAPK1KIF11SMN1; SMN2KMT2A
SCHEMBL15305003 0.70 CYP11B2 (0.59) KIF11
SCHEMBL29590981 0.69 CYP1A2 (0.46) MAPTRAB9AAMY1ANPC1HTT

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
US-4081278-A AND A REDUCIBLE DYE OR DYE PRECURSOR EASTMAN KODAK COMPANY (US) 1978-03-28 US disclosed