SCHEMBL4150683

SCHEMBL4150683

CC1CC(OC(=O)/C=C\C(=O)O)CC(C)(C)C1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
NR1I2 O75469 1/20 0.49
ABCB11 O95342 1/20 0.49
CYP2C9 P11712 3/20 0.48
ALDH1A1 P00352 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
ATM Q13315 1/20 0.39
HCAR2 Q8TDS4 5/20 0.36
THRB P10828 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CTDSP1 Q9GZU7 1/20 0.33
APLNR P35414 1/20 0.32
PPP1CA P62136 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
SCHEMBL4150689 1.00 LMNA (0.49) LMNANR1I2ABCB11CYP2C9ALDH1A1
SCHEMBL272987 0.86 LMNA (0.49) LMNANR1I2ABCB11CYP2C9ALDH1A1
SCHEMBL272988 0.86 LMNA (0.49) LMNANR1I2ABCB11CYP2C9ALDH1A1
SCHEMBL272454 0.86 LMNA (0.49) LMNANR1I2ABCB11CYP2C9ALDH1A1
SCHEMBL272455 0.86 LMNA (0.49) LMNANR1I2ABCB11CYP2C9ALDH1A1
SCHEMBL272986 0.86 LMNA (0.49) LMNANR1I2ABCB11CYP2C9ALDH1A1
Acrylic Acid SCHEMBL28153455 0.83 LMNA (0.48) LMNANR1I2ABCB11CYP2C9ALDH1A1
SCHEMBL24616713 0.81 ATM (0.46) CYP2C9ALDH1A1ATMHCAR2THRB
SCHEMBL36902 0.81 LMNA (0.50) LMNANR1I2ABCB11CYP2C9ALDH1A1
SCHEMBL28554962 0.81 LMNA (0.50) LMNANR1I2ABCB11CYP2C9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247680-A1 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2009-10-01 US disclosed
EP-2024440-A2 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2009-02-18 EP disclosed
WO-2007146603-A2 ADHESION PROMOTING ADDITIVE AVERY DENNISON CORPORATION (US) 2007-12-21 WO disclosed
EP-0140530-B1 LATENTLY-CURABLE ORGANOSILICONE RELEASE COATING COMPOSITION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-03-08 EP disclosed
US-4533575-A ETHYLENICALLY UNSATURATED POLYSILOXANE AND POLYHYDROSILOXANE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-08-06 US disclosed
EP-0140530-A1 Latently-curable organosilicone release coating composition MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-05-08 EP disclosed
US-4504645-A GELATION INHIBITION USING A MONOESTER OR -AMIDE OF AN UNSATURATED DICARBOXYLIC ACID; SHELF LIFE; HEAT CURING MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-03-12 US disclosed