SCHEMBL8375606

SCHEMBL8375606

Cc1ccc(C)c(-c2ccc(O)c(C)c2C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
TRPA1 O75762 1/20 0.46
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
ALOX15 P16050 6/20 0.42
HSD17B10 Q99714 4/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 6/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 4/20 0.41
LMNA P02545 3/20 0.41
ALOX12 P18054 2/20 0.41
GAA P10253 2/20 0.41
USP2 O75604 2/20 0.40
IDO1 P14902 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CSNK2A1 P68400 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
SCHEMBL18171927 0.83 TDP1 (0.58) TP53TDP1TRPA1CNR1CNR2
SCHEMBL16852427 0.81 TRPA1 (0.48) TP53TDP1TRPA1ALOX15HSD17B10
SCHEMBL573212 0.80 AR (0.47) TP53TDP1TRPA1ALOX15HSD17B10
SCHEMBL25878367 0.79 TRPA1 (0.50) TP53TDP1TRPA1CNR1CNR2
SCHEMBL26968681 0.78 LMNA (0.54) TP53TDP1CNR1CNR2ALDH1A1
SCHEMBL197716 0.78 ALDH1A1 (0.52) TP53TDP1TRPA1ALOX15HSD17B10
SCHEMBL1513628 0.75 ATM (0.48) TP53TRPA1ALOX15HSD17B10ALDH1A1
SCHEMBL16122277 0.75 ALDH1A1 (0.56) TP53TDP1TRPA1CNR1CNR2
SCHEMBL5684790 0.74 CASP1 (0.61) TP53TDP1TRPA1CNR1CNR2
SCHEMBL21125927 0.74 ACHE (0.48) TP53TDP1TRPA1ALDH1A1HPGD

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-0659801-B1 Polyimide MITSUI CHEMICALS INC (JP) 1999-03-10 EP disclosed
US-5484880-A HEAT RESISTANT POLYMERS FOR APPLIANCES AND INJECTION MOLDED ARTICLES OR FILMS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-01-16 US disclosed
EP-0659801-A1 Polyimide MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-06-28 EP disclosed