SCHEMBL9558288

SCHEMBL9558288

CC(C)C(COCc1cccc(Oc2ccccc2)c1)c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
TACR1 P25103 5/20 0.43
ALDH1A1 P00352 2/20 0.42
FFAR1 O14842 3/20 0.41
LMNA P02545 3/20 0.40
DAGLA Q9Y4D2 1/20 0.39
ADRA2A P08913 1/20 0.39
CNR1 P21554 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PTGES O14684 1/20 0.39
CCR8 P51685 1/20 0.39
KCNH2 Q12809 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38

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
SCHEMBL9558733 0.89 FFAR1 (0.45) TACR1ALDH1A1FFAR1TDP1PTGES
SCHEMBL9558361 0.88 KDM4E (0.51) TACR1ALDH1A1FFAR1MRGPRX4
SCHEMBL9558968 0.86 FFAR1 (0.52) ALDH1A1FFAR1MRGPRX4
SCHEMBL9558211 0.84 TACR1 (0.36) PPARGTACR1ALDH1A1FFAR1CNR1
SCHEMBL9558603 0.83 TACR1 (0.43) TACR1FFAR1PTGES
SCHEMBL9558366 0.82 ALDH1A1 (0.44) PPARGPPARATACR1ALDH1A1FFAR1
SCHEMBL10548050 0.81 FDFT1 (0.51) PPARGPPARAALDH1A1FFAR1PTGES
SCHEMBL9560487 0.80 PPARG (0.47) PPARGPPARATACR1ALDH1A1FFAR1
SCHEMBL9558340 0.79 PTGES (0.47) TACR1ALDH1A1FFAR1TDP1PTGES
SCHEMBL9559031 0.78 MRGPRX4 (0.39) PPARGPPARATACR1FFAR1MRGPRX4

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 3 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