SCHEMBL8522963

SCHEMBL8522963

C(=CC(c1ccccc1)c1ccccc1)[C](c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 4/20 0.38
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
ATM Q13315 1/20 0.34
CYP2D6 P10635 2/20 0.33
CYP1A2 P05177 1/20 0.33
SRC P12931 1/20 0.33
TSHR P16473 2/20 0.32
CHRM2 P08172 1/20 0.32
ADRA1A P35348 1/20 0.32
PLIN1 O60240 1/20 0.32
BCHE P06276 1/20 0.32
MAPT P10636 1/20 0.32
TNFRSF1A P19438 1/20 0.32
ACHE P22303 1/20 0.32
MAOB P27338 1/20 0.32
RECQL P46063 1/20 0.32
PLIN5 Q00G26 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
SCHEMBL28554105 0.76 HCAR2 (0.47) TDP1L3MBTL1LMNACES2CES1
SCHEMBL8522965 0.75 DPP4 (0.45) LMNACYP2D6CYP1A2SRCTSHR
SCHEMBL28356664 0.72 TDP1 (0.50) TDP1LMNACES2CES1CYP2D6
SCHEMBL18795090 0.72 CYP2D6 (0.41) LMNACES2CES1CYP2D6CYP1A2
SCHEMBL3797767 0.72 SRC (0.39) LMNACES2CES1CYP2D6CYP1A2
SCHEMBL1794030 0.68 L3MBTL1 (0.41) TDP1L3MBTL1LMNACES2CES1
SCHEMBL8989577 0.68 LMNA (0.40) LMNACES2CES1ATMCYP2D6
SCHEMBL9567466 0.68 KMT2A (0.48) TDP1L3MBTL1LMNATSHRMAPT
SCHEMBL9567468 0.68 KMT2A (0.48) TDP1L3MBTL1LMNATSHRMAPT
SCHEMBL20456549 0.67 CYP2D6 (0.41) TDP1L3MBTL1LMNACES2CES1

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
US-5532394-A CONTAINING TITANIUM, DIVALENT MOIETY, LINKING GROUP, MONOVALENT ANIONIC STABILIZING GROUP THE DOW CHEMICAL COMPANY (US) 1996-07-02 US claimed
EP-0778852-B1 THERMOSET ELASTOMERS DOW CHEMICAL CO (US) 1999-10-20 EP disclosed
EP-0632819-B1 ADDITION POLYMERIZATION CATALYSTS COMPRISING REDUCED OXIDATION STATE METAL COMPLEXES DOW CHEMICAL CO (US) 1998-09-02 EP disclosed
EP-0778852-A1 THERMOSET ELASTOMERS THE DOW CHEMICAL COMPANY (US) 1997-06-18 EP disclosed
US-5532394-A CONTAINING TITANIUM, DIVALENT MOIETY, LINKING GROUP, MONOVALENT ANIONIC STABILIZING GROUP THE DOW CHEMICAL COMPANY (US) 1996-07-02 US disclosed
WO-1996007681-A1 THERMOSET ELASTOMERS THE DOW CHEMICAL COMPANY (US) 1996-03-14 WO disclosed