SCHEMBL9558366

SCHEMBL9558366

COc1ccc(C(COCc2cccc(Oc3ccccc3)c2)C(C)C)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PDE10A Q9Y233 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ABCB1 P08183 1/20 0.40
TTR P02766 1/20 0.40
FFAR1 O14842 4/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ACHE P22303 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38
TACR1 P25103 2/20 0.38
REN P00797 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
SCHEMBL9558361 0.87 KDM4E (0.51) ALDH1A1KDM4EMEN1KMT2AHTT
SCHEMBL9558733 0.83 FFAR1 (0.45) ALDH1A1KDM4EHTTSMN1; SMN2FFAR1
SCHEMBL9558288 0.82 PPARG (0.46) ALDH1A1FFAR1PPARGPPARATACR1
SCHEMBL9558603 0.82 TACR1 (0.43) FFAR1TACR1
SCHEMBL9558968 0.81 FFAR1 (0.52) ALDH1A1SMN1; SMN2FFAR1FFAR4
SCHEMBL9558474 0.79 ACHE (0.49) MEN1KMT2APDE10AHDAC8FFAR1
SCHEMBL9558340 0.76 PTGES (0.47) ALDH1A1KDM4EHTTSMN1; SMN2FFAR1
SCHEMBL9559031 0.73 MRGPRX4 (0.39) MEN1KMT2AFFAR1PPARGPPARA
SCHEMBL10851488 0.73 KDM4E (0.45) ALDH1A1KDM4EMEN1KMT2APDE10A
SCHEMBL9560683 0.72 KDM4E (0.50) ALDH1A1KDM4EMEN1KMT2AHTT

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-0257415-B1 INSECTICIDAL RESIN COATING FILM MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-03-31 EP disclosed
US-4997650-A (Meth)acrylonitrile polymer MITSUI TOATSU CHEMICALS, INC. (JP) 1991-03-05 US disclosed
US-4818525-A LONG-LASTING; ACRYLONITRILE COPOLYMER MITSUI TOATSU CHEMICALS, INC. (JP) 1989-04-04 US disclosed
EP-0257415-A1 Insecticidal resin coating film MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-03-02 EP disclosed