SCHEMBL9558197

SCHEMBL9558197

Cc1ccc(C(C)(C)COCc2cccc(Oc3ccccc3)c2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.42
FFAR4 Q5NUL3 2/20 0.42
NPC1 O15118 2/20 0.40
CYP2C9 P11712 2/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
CETP P11597 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.38
ADRA2A P08913 1/20 0.38
CNR1 P21554 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 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
SCHEMBL9558311 0.90 PPARG (0.40) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL10853031 0.90 CETP (0.38) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL10851749 0.90 PPARG (0.40) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL10852698 0.90 MRGPRX4 (0.40) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL10853065 0.90 FFAR1 (0.41) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL10854551 0.89 PPARG (0.41) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL10859391 0.89 NPC1 (0.49) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL9557898 0.89 MRGPRX4 (0.41) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL10852488 0.89 FFAR1 (0.40) FFAR1FFAR4NPC1CYP2C9POLB
SCHEMBL10855858 0.88 NPC1 (0.43) FFAR1FFAR4NPC1CYP2C9POLB

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