SCHEMBL6574591

SCHEMBL6574591

[c]1ccc(C2CCCCC2c2cc[c]cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
S1PR1 P21453 1/20 0.33
MDM2 Q00987 1/20 0.32
FABP7 O15540 2/20 0.31
FABP3 P05413 2/20 0.31
FABP5 Q01469 2/20 0.31
SSTR4 P31391 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
SCHEMBL14672825 0.84 MEN1 (0.32) MEN1KMT2A
SCHEMBL4618388 0.84 AR (0.43) MEN1KMT2AFABP7FABP3FABP5
SCHEMBL17090729 0.81 MEN1 (0.38) MEN1KMT2AS1PR1FABP7FABP3
SCHEMBL17090750 0.80 MEN1 (0.37) MEN1KMT2AS1PR1
SCHEMBL21538 0.79 ESR2 (0.42) KMT2A
SCHEMBL8088123 0.77
SCHEMBL676555 0.77 CYP11B2 (0.42) KMT2A
SCHEMBL22833 0.77 CYP11B2 (0.42) KMT2A
SCHEMBL5543159 0.77 CYP11B2 (0.42) KMT2A
SCHEMBL2911926 0.77 CYP11B2 (0.42) KMT2A

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-1044227-B1 PARTIALLY POLYMERIZED MIXTURE OF DIETHYLENE GLYCOL (ALLYL CARBONATE) COMPOUNDS PPG IND OHIO INC (US) 2004-04-28 EP disclosed
EP-1044228-B1 PROCESS FOR FORMING POLY(ALLYL CARBONATE)-FUNCTIONAL PREPOLYMER COMPOSITION PPG IND OHIO INC (US) 2002-07-10 EP disclosed
US-6057411-A HEATING ALLYL CARBONATE WITH FREE RADICAL INITIATOR FOR POLYMERIZATION PPG INDUSTRIES OHIO, INC. (US) 2000-05-02 US disclosed
US-5952441-A LOW SHRINKAGE IN THE MOLD BY ADDING A PREPOLYMER COMPRISING PARTIAL POLYMERIZED ETHYLENIC DOUBLE BONDS PPG INDUSTRIES OHIO, INC. (US) 1999-09-14 US disclosed