SCHEMBL7524048

SCHEMBL7524048

C=Cc1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.39
TSHR P16473 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
TRPA1 O75762 1/20 0.36
TRIM24 O15164 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35
NFKB1 P19838 3/20 0.34
CA2 P00918 3/20 0.34
CA1 P00915 1/20 0.34
CA4 P22748 1/20 0.34
KIF11 P52732 1/20 0.34
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
GFER P55789 1/20 0.32
KMT2A Q03164 1/20 0.32
CA12 O43570 2/20 0.32
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32

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
SCHEMBL7524435 0.87 ALDH1A1 (0.41) ALDH1A1TSHRKDM4EHTT
SCHEMBL30035564 0.84 ALDH1A1 (0.52) ALDH1A1TSHRTDP1NFKB1CA2
SCHEMBL584286 0.84 ALDH1A1 (0.52) ALDH1A1TSHRTDP1NFKB1CA2
SCHEMBL7519718 0.81 ERN1 (0.46) ALDH1A1TSHRTDP1TRIM24TRIM33
SCHEMBL7524052 0.81 ALDH1A1 (0.43) ALDH1A1TSHRTDP1TRPA1CA2
SCHEMBL7161191 0.80 ALDH1A1 (0.52) ALDH1A1TSHRTDP1NFKB1CA2
SCHEMBL31205557 0.80 ALDH1A1 (0.52) ALDH1A1TSHRTDP1NFKB1CA2
SCHEMBL384048 0.80 ALDH1A1 (0.52) ALDH1A1TSHRTDP1NFKB1CA2
SCHEMBL7526236 0.80 ALOX15 (0.35) TSHRTRPA1
Ammonia Solution, Strong SCHEMBL31387947 0.78 ALDH1A1 (0.50) ALDH1A1TSHRTDP1NFKB1CA2

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-1179025-A1 SUPPORTED CATALYSTS AND OLEFIN POLYMERIZATION PROCESSES UTILIZING SAME Cryovac, Inc. (US) 2002-02-13 EP disclosed
US-6197715-B1 USEFUL IN SLURRY AND GAS PHASE POLYMERIZATION OF OLEFINS CRYOVAC, INC. 2001-03-06 US disclosed
WO-2000056787-A1 SUPPORTED CATALYSTS AND OLEFIN POLYMERIZATION PROCESSES UTILIZING SAME CRYOVAC, INC. (US) 2000-09-28 WO disclosed