SCHEMBL4780260

SCHEMBL4780260

C=C(C)c1ccccc1.C=CC=Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.49
MAOB P27338 2/20 0.46
GLA P06280 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 3/20 0.41
TRPA1 O75762 1/20 0.41
ALOX5 P09917 1/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 2/20 0.40
CYP1B1 Q16678 2/20 0.40
TNFRSF1A P19438 2/20 0.40
PLIN1 O60240 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
RECQL P46063 1/20 0.40
PLIN5 Q00G26 1/20 0.40
ABHD5 Q8WTS1 1/20 0.40
CYP2C19 P33261 1/20 0.40
PLA2G7 Q13093 1/20 0.39

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
SCHEMBL11275103 0.93 CYP3A4 (0.50) CYP3A4MAOBGLATDP1LMNA
SCHEMBL4359280 0.85 CYP3A4 (0.51) CYP3A4MAOBGLATDP1LMNA
SCHEMBL4359283 0.85 CYP3A4 (0.51) CYP3A4MAOBGLATDP1LMNA
SCHEMBL8420384 0.84 CYP2C19 (0.46) CYP3A4MAOBGLATDP1LMNA
SCHEMBL27513947 0.83 CYP3A4 (0.50) CYP3A4MAOBGLATDP1LMNA
Acetone SCHEMBL10911886 0.82 GLA (0.55) CYP3A4MAOBGLATDP1LMNA
SCHEMBL993230 0.82 CYP3A4 (0.50) CYP3A4MAOBGLATDP1LMNA
Benzene SCHEMBL11589819 0.82 AKT1 (0.44) MAOBTDP1LMNAALDH1A1MAPK1
Butadiene SCHEMBL9246918 0.82 AKT1 (0.44) MAOBTDP1LMNAALDH1A1MAPK1
Butadiene SCHEMBL2781676 0.82 AKT1 (0.44) MAOBTDP1LMNAALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1368981-A Azidosilane-modified, moisture-curable polyolefin polymers, process for making and articles obtained therefrom DOW CHEMICAL CO (US) 2002-09-11 CN claimed
EP-1364975-B1 PROCESSES FOR PRODUCING CYCLOOLEFIN ADDITION POLYMER JSR CORP (JP) 2008-04-30 EP disclosed
US-6911507-B2 Processes for producing cycloolefin addition polymer JSR CORPORATION (JP) 2005-06-28 US disclosed
US-20040063873-A1 Processes for producing cycloolefin addition polymer JSR CORPORATION (JP) 2004-04-01 US disclosed
EP-1364975-A1 PROCESSES FOR PRODUCING CYCLOOLEFIN ADDITION POLYMER JSR Corporation (JP) 2003-11-26 EP disclosed