SCHEMBL4248469

SCHEMBL4248469

CC(C)(c1ccccc1)C1CC(=O)C=CC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
CYP2C19 P33261 2/20 0.36
CYP2C9 P11712 1/20 0.36
HIF1A Q16665 1/20 0.34
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
KCNN4 O15554 2/20 0.31
MAPK1 P28482 1/20 0.31
MT-CO2 P00403 1/20 0.31
ALOX5 P09917 1/20 0.31
LMNA P02545 1/20 0.31
CYP2B6 P20813 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC7 Q8WUI4 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC10 Q969S8 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
SCHEMBL2412614 0.75 NFKB1 (0.33) NFKB1NFKB2RELAMAPK1
SCHEMBL9932801 0.72 ALDH1A1 (0.36) CYP2C19CYP2C9HIF1AMAPTKMT2A
SCHEMBL16283604 0.71 MAPT (0.41) CYP2C19CYP2C9HIF1AMAPTKMT2A
SCHEMBL11625994 0.69 BRD4 (0.41) CYP2C19CYP2C9LMNAHDAC8
SCHEMBL9669676 0.69 CYP2C19 (0.39) CYP2C19CYP2C9HIF1AMAPTKMT2A
SCHEMBL9971685 0.67 PLAU (0.34) CYP2C19CYP2C9HIF1AMAPTKMT2A
SCHEMBL11467541 0.66 MCL1 (0.44) CYP2C19CYP2C9MAPTKMT2AMT-CO2
SCHEMBL11873477 0.64 CYP2C9 (0.38) CYP2C19CYP2C9MAPK1LMNACYP2B6
SCHEMBL24342011 0.63 MAPK1 (0.41) NFKB1NFKB2RELACYP2C19HIF1A
SCHEMBL7052576 0.63 MAPK1 (0.41) NFKB1NFKB2RELACYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2084227-A1 THERMOPLASTIC COMPOSITION, METHOD OF MANUFACTURE THEREOF, AND ARTICLES DERIVED THEREFROM Sabic Innovative Plastics IP B.V. (NL) 2009-08-05 EP disclosed
WO-2008063724-A1 THERMOPLASTIC COMPOSITION, METHOD OF MANUFACTURE THEREOF, AND ARTICLES DERIVED THEREFROM SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-05-29 WO disclosed
EP-0694572-B1 A method for manufacturing polycarbonate GEN ELECTRIC (US) 2000-05-10 EP disclosed
EP-0694572-A2 A method for manufacturing polycarbonate GENERAL ELECTRIC COMPANY (US) 1996-01-31 EP disclosed