SCHEMBL7524435

SCHEMBL7524435

C=Cc1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
TSHR P16473 4/20 0.37
KCNN4 O15554 3/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.32
ALOX15 P16050 1/20 0.31

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
SCHEMBL7524048 0.87 ALDH1A1 (0.39) ALDH1A1TSHRKDM4EHTT
SCHEMBL28725067 0.83 ALDH1A1 (0.44) ALDH1A1TSHRKCNN4
SCHEMBL4789180 0.79 ALDH1A1 (0.41) ALDH1A1TSHRKCNN4MAPK1KDM4E
SCHEMBL28831873 0.79 ALDH1A1 (0.39) ALDH1A1TSHRKCNN4KDM4EHTT
SCHEMBL146715 0.79 ALDH1A1 (0.43) ALDH1A1TSHRKCNN4KDM4EHTT
SCHEMBL28706855 0.79 ESR1 (0.41) ALDH1A1TSHRKCNN4MAPK1KDM4E
SCHEMBL7519718 0.79 ERN1 (0.46) ALDH1A1TSHR
SCHEMBL12004564 0.78 LMNA (0.50) ALDH1A1TSHRKCNN4MAPK1HTT
SCHEMBL7526236 0.78 ALOX15 (0.35) TSHRALOX15
Benzene SCHEMBL11667348 0.76 ALDH1A1 (0.48) ALDH1A1TSHR

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-1179025-A1 SUPPORTED CATALYSTS AND OLEFIN POLYMERIZATION PROCESSES UTILIZING SAME Cryovac, Inc. (US) 2002-02-13 EP disclosed
EP-1171481-A1 SUPPORTED CATALYSTS AND OLEFIN POLYMERIZATION PROCESSES UTILIZING SAME Cryovac, Inc. (US) 2002-01-16 EP disclosed
US-6197714-B1 USEFUL IN SLURRY AND GAS PHASE POLYMERIZATION OF OLEFINS CRYOVAC, INC. 2001-03-06 US 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
WO-2000056786-A1 SUPPORTED CATALYSTS AND OLEFIN POLYMERIZATION PROCESSES UTILIZING SAME CRYOVAC, INC. (US) 2000-09-28 WO disclosed