SCHEMBL9558346

SCHEMBL9558346

CC(C)(COCc1cccc(Oc2ccccc2)c1)c1ccc2c(c1)OCO2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.45
FAAH O00519 1/20 0.41
MAOA P21397 4/20 0.41
LMNA P02545 2/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 1/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP13 P45452 1/20 0.39
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
CALM1 P0DP23 2/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
HPGD P15428 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
SCHEMBL10850171 0.89 MAOB (0.42) MAOBFAAHMAOALMNAHTT
SCHEMBL10864723 0.88 MAOB (0.41) MAOBFAAHMAOALMNAHTT
SCHEMBL9561217 0.84 MAOB (0.41) MAOBFAAHMAOALMNAHTT
SCHEMBL9561103 0.84 MAOB (0.41) MAOBFAAHMAOALMNAHTT
SCHEMBL9557718 0.84 MAOB (0.39) MAOBMAOALMNAHTTALDH1A1
SCHEMBL9558206 0.83 MAOB (0.47) MAOBFAAHMAOAALDH1A1MAPK1
SCHEMBL10859391 0.83 NPC1 (0.49) FAAHLMNAHTTALDH1A1MMP1
SCHEMBL10878379 0.82 MAOB (0.58) MAOBMAOALMNAHTTCALM1
SCHEMBL10532258 0.81 NPC1 (0.44) LMNAHTTALDH1A1MMP1KMT2A
SCHEMBL9558197 0.81 FFAR1 (0.42) LMNAHTTALDH1A1MMP1KDM4E

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 6 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
US-4570005-A REACTING THE ARYL PROPYL CHLORIDE WITH THE CORRESPONDING ARYL ALCOHOL OR ARYL MERCAPTAN MITSUITOATSU CHEMICALS INC. (JP) 1986-02-11 US disclosed
US-4397864-A LOW TOXICITY MITSUITOATSU CHEMICALS INC. (JP) 1983-08-09 US disclosed