SCHEMBL6650445

SCHEMBL6650445

CCCc1ccccc1-c1cccc2c1C=C[CH]2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
PPARA Q07869 1/20 0.31
ELANE P08246 1/20 0.30
CTSG P08311 1/20 0.30

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
SCHEMBL6650685 0.91 NR1H2 (0.38) NR1H2NR1H3PPARAELANECTSG
SCHEMBL6652215 0.87 CSNK2A2 (0.36)
SCHEMBL28030816 0.80 DPP4 (0.46)
SCHEMBL6648232 0.79 GABRA1 (0.41) ELANECTSG
SCHEMBL6704515 0.76 PPARA (0.41) NR1H2NR1H3PPARAELANECTSG
SCHEMBL28041352 0.75 DPP4 (0.45)
SCHEMBL6649547 0.74 HTR7 (0.35)
SCHEMBL3274492 0.73 LIPG (0.42) NR1H2NR1H3PPARA
SCHEMBL1071199 0.73 GABRA1 (0.41)
SCHEMBL219160 0.73 NR1H2 (0.34) NR1H2NR1H3PPARAELANECTSG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1421090-A2 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM Exxonmobil Chemical Patents Inc. (US) 2004-05-26 EP disclosed
WO-2003002583-A2 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-01-09 WO disclosed